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srDFT_GW/Manuscript/GW.bib
Pierre-Francois Loos 0bc3529626 bib file
2019-10-01 19:28:13 +02:00

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%% This BibTeX bibliography file was created using BibDesk.
%% http://bibdesk.sourceforge.net/
%% Created for Pierre-Francois Loos at 2018-09-01 12:03:55 +0200
%% Saved with string encoding Unicode (UTF-8)
@article{Lee_2018,
Author = {J. Lee and M. Head-Gordon},
Date-Added = {2018-09-01 12:02:40 +0200},
Date-Modified = {2018-09-01 12:03:38 +0200},
Doi = {10.1021/acs.jctc.8b00731},
Journal = {J. Chem. Theory Comput.},
Pages = {ASAP article},
Title = {Regularized Orbital-Optimized Second-Order M{\o}ller--Plesset Perturbation Theory: A Reliable Fifth-Order-Scaling Electron Correlation Model with Orbital Energy Dependent Regularizers},
Year = {2018}}
@article{Scuseria_1986,
Author = {G. E. Scuseria and T. J. Lee and H. F. {Schaefer III}},
Date-Added = {2018-09-01 11:53:43 +0200},
Date-Modified = {2018-09-01 12:03:54 +0200},
Doi = {10.1016/0009-2614(86)80461-4},
Journal = {Chem. Phys. Lett.},
Pages = {236--239},
Title = {Accelerating the convergence of the coupled-cluster approach: The use of the DIIS method},
Volume = {130},
Year = {1986}}
@article{Sangalli_2011,
Author = {D. Sangalli and P. Romaniello and G. Onida and A. Marini},
Date-Added = {2018-08-21 22:20:47 +0200},
Date-Modified = {2018-08-21 22:21:46 +0200},
Doi = {10.1063/1.3518705},
Journal = {J. Chem. Phys.},
Pages = {034115},
Title = {Double excitations in correlated systems: A many--body approach},
Volume = {134},
Year = {2011},
Bdsk-Url-1 = {https://doi.org/10.1063/1.3518705}}
@article{Li_2014,
Author = {Li, Zhendong and Suo, Bingbing and Liu, Wenjian},
Date-Added = {2018-07-08 13:37:50 +0000},
Date-Modified = {2018-07-08 13:37:50 +0000},
Doi = {10.1063/1.4903986},
File = {/Users/loos/Zotero/storage/48QYYQAM/Li et al. - 2014 - First order nonadiabatic coupling matrix elements .pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = dec,
Number = {24},
Pages = {244105},
Shorttitle = {First Order Nonadiabatic Coupling Matrix Elements between Excited States},
Title = {First Order Nonadiabatic Coupling Matrix Elements between Excited States: {{Implementation}} and Application at the {{TD}}-{{DFT}} and Pp-{{TDA}} Levels},
Volume = {141},
Year = {2014},
Bdsk-Url-1 = {https://doi.org/10.1063/1.4903986}}
@article{Ou_2015,
Author = {Ou, Qi and Bellchambers, Gregory D. and Furche, Filipp and Subotnik, Joseph E.},
Date-Added = {2018-07-08 13:37:50 +0000},
Date-Modified = {2018-07-08 13:37:50 +0000},
Doi = {10.1063/1.4906941},
File = {/Users/loos/Zotero/storage/8YBF69YK/Ou et al. - 2015 - First-order derivative couplings between excited s.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = feb,
Number = {6},
Pages = {064114},
Title = {First-Order Derivative Couplings between Excited States from Adiabatic {{TDDFT}} Response Theory},
Volume = {142},
Year = {2015},
Bdsk-Url-1 = {https://doi.org/10.1063/1.4906941}}
@article{Zhang_2015,
Author = {Zhang, Xing and Herbert, John M.},
Date-Added = {2018-07-08 13:37:50 +0000},
Date-Modified = {2018-07-08 13:37:50 +0000},
Doi = {10.1063/1.4907376},
File = {/Users/loos/Zotero/storage/DHB7LEFQ/Zhang and Herbert - 2015 - Analytic derivative couplings in time-dependent de.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = feb,
Number = {6},
Pages = {064109},
Shorttitle = {Analytic Derivative Couplings in Time-Dependent Density Functional Theory},
Title = {Analytic Derivative Couplings in Time-Dependent Density Functional Theory: {{Quadratic}} Response Theory versus Pseudo-Wavefunction Approach},
Volume = {142},
Year = {2015},
Bdsk-Url-1 = {https://doi.org/10.1063/1.4907376}}
@article{DiSabatino_2016,
Author = {Di Sabatino, Stefano and Berger, J. A. and Reining, Lucia and Romaniello, Pina},
Date-Added = {2018-07-06 11:15:19 +0000},
Date-Modified = {2018-07-18 13:09:33 +0000},
Doi = {10.1103/PhysRevB.94.155141},
Issn = {2469-9950, 2469-9969},
Journal = {Physical Review B},
Language = {en},
Month = oct,
Number = {15},
Pages = {155141},
Shorttitle = {Photoemission Spectra from Reduced Density Matrices},
Title = {Photoemission Spectra from Reduced Density Matrices: {{The}} Band Gap in Strongly Correlated Systems},
Volume = {94},
Year = {2016},
Bdsk-Url-1 = {https://doi.org/10.1103/PhysRevB.94.155141}}
@article{DiSabatino_2015,
Author = {Di Sabatino,S. and Berger,J. A. and Reining,L. and Romaniello,P.},
Doi = {10.1063/1.4926327},
Journal = {J. Chem. Phys.},
Number = {2},
Pages = {024108},
Title = {Reduced density-matrix functional theory: Correlation and spectroscopy},
Volume = {143},
Year = {2015},
Bdsk-Url-1 = {https://doi.org/10.1063/1.4926327}}
@article{Gui_2018,
Abstract = {The performance of the Bethe-Salpeter equation (BSE) approach for the first-principles computation of singlet and triplet excitation energies of small organic, closed-shell molecules has been assessed with respect to the quasiparticle energies used on input, obtained at various levels of GW theory. In the corresponding GW computations, quasiparticle energies have been computed for all orbital levels by means of using full spectral functions. The assessment reveals that, for valence excited states, quasiparticle energies obtained at the levels of eigenvalue-only self-consistent (evGW) or quasiparticle self-consistent theory (qsGW) are required to obtain results of comparable accuracy as in timedependent density-functional theory (TDDFT) using a hybrid functional such as PBE0. In contrast to TDDFT, however, the BSE approach performs well not only for valence excited states but also for excited states with Rydberg or charge-transfer character. To demonstrate the applicability of the BSE approach, computation times are reported for a set of aromatic hydrocarbons. Furthermore, examples of computations of ordinary photoabsorption and electronic circular dichroism spectra are presented for (C60)2 and C84, respectively.},
Author = {Gui, Xin and Holzer, Christof and Klopper, Wim},
Date-Added = {2018-07-06 11:01:02 +0000},
Date-Modified = {2018-07-06 11:04:53 +0000},
Doi = {10.1021/acs.jctc.8b00014},
File = {/Users/loos/Zotero/storage/IUX26JSD/Gui et al. - 2018 - Accuracy Assessment of iGWi Starting Points f.pdf},
Issn = {1549-9618, 1549-9626},
Journal = {J. Chem. Theory Comput.},
Language = {en},
Month = apr,
Number = {4},
Pages = {2127-2136},
Title = {Accuracy {{Assessment}} of {{{\emph{GW}}}} {{Starting Points}} for {{Calculating Molecular Excitation Energies Using}} the {{Bethe}}\textendash{{Salpeter Formalism}}},
Volume = {14},
Year = {2018},
Bdsk-Url-1 = {https://doi.org/10.1021/acs.jctc.8b00014}}
@article{Langre_2018,
Author = {M. F. Lange and T. C. Berkelbach},
Date-Added = {2018-07-06 10:58:12 +0000},
Date-Modified = {2018-07-06 11:05:42 +0000},
Journal = {arXiv},
Pages = {1805.00043},
Title = {On The Relation Between Equation-of-Motion Coupled-Cluster Theory and the GW Approximation},
Year = {2018}}
@article{Parker_2016,
Author = {Parker, Shane M. and Roy, Saswata and Furche, Filipp},
Date-Added = {2018-07-05 14:45:36 +0000},
Date-Modified = {2018-07-05 14:45:36 +0000},
Doi = {10.1063/1.4963749},
File = {/Users/loos/Zotero/storage/GZA8PHWK/Parker et al. - 2016 - Unphysical divergences in response theory.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {The Journal of Chemical Physics},
Language = {en},
Month = oct,
Number = {13},
Pages = {134105},
Title = {Unphysical Divergences in Response Theory},
Volume = {145},
Year = {2016},
Bdsk-Url-1 = {https://doi.org/10.1063/1.4963749}}
@article{Cave_2004,
Abstract = {The nature and energetics of the low-lying singlet states of polyenes have presented significant challenges for electronic structure methods. This is particularly true for conventional implementations of time-dependent density functional theory (TDDFT), which, because of their use of the adiabatic approximation, have difficulty in describing states of `doubly-excited character'. We show that use of our recently developed `Dressed TDDFT' approach provides a compact and accurate method for treating these doubly excited states, by use of a frequency-dependent exchange-correlation kernel. We present results for the vertical absorption energy for the 21Ag states of butadiene and hexatriene, and the vertical fluorescence and 0\textendash{}0 transitions for the 21Ag state of butadiene.},
Author = {Cave, Robert J. and Zhang, Fan and Maitra, Neepa T. and Burke, Kieron},
Date-Added = {2018-07-05 08:28:40 +0000},
Date-Modified = {2018-07-05 09:24:39 +0000},
Doi = {10.1016/j.cplett.2004.03.051},
File = {/Users/loos/Zotero/storage/G6AZSCLV/Cave et al. - 2004 - A dressed TDDFT treatment of the 21Ag states of bu.pdf},
Issn = {00092614},
Journal = {Chem. Phys. Lett.},
Language = {en},
Month = may,
Number = {1-3},
Pages = {39--42},
Title = {A Dressed {{TDDFT}} Treatment of the {{21Ag}} States of Butadiene and Hexatriene},
Volume = {389},
Year = {2004},
Bdsk-Url-1 = {https://doi.org/10.1016/j.cplett.2004.03.051}}
@article{Becke_1993,
Author = {A. D. Becke},
Date-Added = {2018-07-04 21:18:18 +0000},
Date-Modified = {2018-07-18 13:08:55 +0000},
Doi = {10.1063/1.464913},
Journal = {J. Chem. Phys.},
Pages = {5648--5652},
Title = {Density-Functional Thermochemistry. III. The Role of Exact Exchange},
Volume = {98},
Year = {1993},
Bdsk-Url-1 = {https://doi.org/10.1063/1.464913}}
@article{Perdew_1996,
Author = {J. P. Perdew and K. Burke and M. Ernzerhof},
Date-Added = {2018-07-04 21:11:12 +0000},
Date-Modified = {2018-07-18 13:08:03 +0000},
Doi = {10.1103/PhysRevLett.77.3865},
Journal = {Phys. Rev. Lett.},
Pages = {3865--3868},
Title = {Generalized Gradient Approximation Made Simple},
Volume = {77},
Year = {1996},
Bdsk-Url-1 = {https://doi.org/10.1103/PhysRevLett.77.3865}}
@book{ParrBook,
Address = {Clarendon Press},
Author = {R. G. Parr and W. Yang},
Date-Added = {2018-07-04 21:10:00 +0000},
Date-Modified = {2018-07-04 21:10:00 +0000},
Keywords = {dft; qmech},
Publisher = {Oxford},
Title = {Density-functional theory of atoms and molecules},
Year = {1989}}
@article{Gill_1994,
Author = {P. M. W. Gill},
Date-Added = {2018-07-04 20:48:56 +0000},
Date-Modified = {2018-07-18 13:07:04 +0000},
Doi = {10.1016/S0065-3276(08)60019-2},
Journal = {Adv. Quantum Chem.},
Pages = {141--205},
Title = {Molecular Integrals Over Gaussian Basis Functions},
Volume = {25},
Year = {1994},
Bdsk-Url-1 = {https://doi.org/10.1016/S0065-3276(08)60019-2}}
@article{Pavlyukh_2017,
Author = {Y. Pavlyukh},
Date-Added = {2018-07-04 15:36:10 +0000},
Date-Modified = {2018-07-04 15:38:19 +0000},
Doi = {10.1038/s41598-017-00355-w},
Journal = {Nature},
Pages = {504},
Title = {Pade resummation of many-body perturbation theory},
Volume = {7},
Year = {2017},
Bdsk-Url-1 = {https://doi.org/10.1038/s41598-017-00355-w}}
@book{HerzbergBook,
Author = {K. P. Huber and G. Herzberg},
Date-Added = {2018-07-02 11:52:15 +0000},
Date-Modified = {2018-07-02 11:52:15 +0000},
Publisher = {van Nostrand Reinhold Company},
Title = {Molecular Spectra and Molecular Structure: IV. Constants of diatomic molecules},
Year = {1979}}
@article{Maitra_2004,
Author = {N. T. Maitra and F. Zhang, R. J. Cave and K. Burke},
Date-Added = {2018-06-30 20:21:46 +0000},
Date-Modified = {2018-06-30 20:23:01 +0000},
Doi = {10.1063/1.1651060},
Journal = {J. Chem. Phys.},
Pages = {5932},
Title = {Double excitations within time-dependent density functional theory linear response},
Volume = {120},
Year = {2004},
Bdsk-Url-1 = {https://doi.org/10.1063/1.1651060}}
@article{Caruso_2016,
Author = {F. Caruso and M. Dauth and M. J. {van Setten} and P. Rinke},
Date-Added = {2018-06-29 11:23:57 +0000},
Date-Modified = {2018-06-29 11:25:49 +0000},
Doi = {10.1021/acs.jctc.6b00774},
Journal = {J. Chem. Theory Comput.},
Pages = {5076},
Title = {Benchmark of GW Approaches for the GW100 Test Set},
Volume = {12},
Year = {2016},
Bdsk-Url-1 = {https://doi.org/10.1021/acs.jctc.6b00774}}
@article{Loos_2018,
Author = {P. F. Loos and P. Romaniello and J. A. Berger},
Date-Added = {2018-06-27 18:40:35 +0000},
Date-Modified = {2018-07-18 13:04:09 +0000},
Doi = {10.1021/acs.jctc.8b00260},
Journal = {J. Chem. Theory Comput.},
Pages = {3071--3082},
Title = {Green functions and self-consistency: insights from the spherium model},
Volume = {14},
Year = {2018},
Bdsk-Url-1 = {https://dx.doi.org/10.1021/acs.jctc.8b00260}}
@article{Curtiss_1991,
Author = {Curtiss, Larry A. and Raghavachari, Krishnan and Trucks, Gary W. and Pople, John A.},
Date-Added = {2018-04-23 07:38:41 +0000},
Date-Modified = {2018-04-23 07:38:41 +0000},
Doi = {10.1063/1.460205},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = jun,
Number = {11},
Pages = {7221-7230},
Title = {Gaussian-2 Theory for Molecular Energies of First- and Second-row Compounds},
Volume = {94},
Year = {1991},
Bdsk-Url-1 = {https://doi.org/10.1063/1.460205}}
@article{Jacquemin_2015,
Author = {Jacquemin, Denis and Duchemin, Ivan and Blase, Xavier},
Date-Added = {2018-04-23 07:38:41 +0000},
Date-Modified = {2018-04-23 07:38:41 +0000},
Doi = {10.1021/acs.jctc.5b00304},
Issn = {1549-9618, 1549-9626},
Journal = {J. Chem. Theory Comput.},
Language = {en},
Month = jul,
Number = {7},
Pages = {3290-3304},
Title = {Benchmarking the {{Bethe}}\textendash{}{{Salpeter Formalism}} on a {{Standard Organic Molecular Set}}},
Volume = {11},
Year = {2015},
Bdsk-Url-1 = {https://doi.org/10.1021/acs.jctc.5b00304}}
@article{Schreiber_2008,
Author = {Schreiber, Marko and Silva-Junior, Mario R. and Sauer, Stephan P. A. and Thiel, Walter},
Date-Added = {2018-04-23 07:38:41 +0000},
Date-Modified = {2018-04-23 07:38:41 +0000},
Doi = {10.1063/1.2889385},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = apr,
Number = {13},
Pages = {134110},
Shorttitle = {Benchmarks for Electronically Excited States},
Title = {Benchmarks for Electronically Excited States: {{CASPT2}}, {{CC2}}, {{CCSD}}, and {{CC3}}},
Volume = {128},
Year = {2008},
Bdsk-Url-1 = {https://doi.org/10.1063/1.2889385}}
@article{Silva-Junior_2010,
Author = {Silva-Junior, Mario R. and Schreiber, Marko and Sauer, Stephan P. A. and Thiel, Walter},
Date-Added = {2018-04-23 07:38:41 +0000},
Date-Modified = {2018-04-23 07:38:41 +0000},
Doi = {10.1063/1.3499598},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = nov,
Number = {17},
Pages = {174318},
Shorttitle = {Benchmarks of Electronically Excited States},
Title = {Benchmarks of Electronically Excited States: {{Basis}} Set Effects on {{CASPT2}} Results},
Volume = {133},
Year = {2010},
Bdsk-Url-1 = {https://doi.org/10.1063/1.3499598}}
@article{Silva-Junior_2010b,
Author = {Silva-Junior, Mario R. and Sauer, Stephan P.A. and Schreiber, Marko and Thiel, Walter},
Date-Added = {2018-04-23 07:38:41 +0000},
Date-Modified = {2018-04-23 07:38:41 +0000},
Doi = {10.1080/00268970903549047},
Issn = {0026-8976, 1362-3028},
Journal = {Mol. Phys.},
Language = {en},
Month = feb,
Number = {3-4},
Pages = {453-465},
Shorttitle = {Basis Set Effects on Coupled Cluster Benchmarks of Electronically Excited States},
Title = {Basis Set Effects on Coupled Cluster Benchmarks of Electronically Excited States: {{CC3}}, {{CCSDR}}(3) and {{CC2}}},
Volume = {108},
Year = {2010},
Bdsk-Url-1 = {https://doi.org/10.1080/00268970903549047}}
@article{Dolgounitcheva_2016,
Author = {Dolgounitcheva, O. and D{\'\i}az-Tinoco, Manuel and Zakrzewski, V. G. and Richard, Ryan M. and Marom, Noa and Sherrill, C. David and Ortiz, J. V.},
Date-Added = {2018-04-22 16:22:34 +0000},
Date-Modified = {2018-04-22 16:22:34 +0000},
Doi = {10.1021/acs.jctc.5b00872},
Issn = {1549-9618, 1549-9626},
Journal = {J. Chem. Theory Comput.},
Language = {en},
Month = feb,
Number = {2},
Pages = {627-637},
Shorttitle = {Accurate {{Ionization Potentials}} and {{Electron Affinities}} of {{Acceptor Molecules IV}}},
Title = {Accurate {{Ionization Potentials}} and {{Electron Affinities}} of {{Acceptor Molecules IV}}: {{Electron}}-{{Propagator Methods}}},
Volume = {12},
Year = {2016},
Bdsk-Url-1 = {https://doi.org/10.1021/acs.jctc.5b00872}}
@article{Gallandi_2016,
Author = {Gallandi, Lukas and Marom, Noa and Rinke, Patrick and K{\"o}rzd{\"o}rfer, Thomas},
Date-Added = {2018-04-22 16:22:34 +0000},
Date-Modified = {2018-04-22 16:22:34 +0000},
Doi = {10.1021/acs.jctc.5b00873},
Issn = {1549-9618, 1549-9626},
Journal = {J. Chem. Theory Comput.},
Language = {en},
Month = feb,
Number = {2},
Pages = {605-614},
Shorttitle = {Accurate {{Ionization Potentials}} and {{Electron Affinities}} of {{Acceptor Molecules II}}},
Title = {Accurate {{Ionization Potentials}} and {{Electron Affinities}} of {{Acceptor Molecules II}}: {{Non}}-{{Empirically Tuned Long}}-{{Range Corrected Hybrid Functionals}}},
Volume = {12},
Year = {2016},
Bdsk-Url-1 = {https://doi.org/10.1021/acs.jctc.5b00873}}
@article{Knight_2016,
Author = {Knight, Joseph W. and Wang, Xiaopeng and Gallandi, Lukas and Dolgounitcheva, Olga and Ren, Xinguo and Ortiz, J. Vincent and Rinke, Patrick and K{\"o}rzd{\"o}rfer, Thomas and Marom, Noa},
Date-Added = {2018-04-22 16:22:34 +0000},
Date-Modified = {2018-04-22 16:22:34 +0000},
Doi = {10.1021/acs.jctc.5b00871},
Issn = {1549-9618, 1549-9626},
Journal = {J. Chem. Theory Comput.},
Language = {en},
Month = feb,
Number = {2},
Pages = {615-626},
Shorttitle = {Accurate {{Ionization Potentials}} and {{Electron Affinities}} of {{Acceptor Molecules III}}},
Title = {Accurate {{Ionization Potentials}} and {{Electron Affinities}} of {{Acceptor Molecules III}}: {{A Benchmark}} of {{{\emph{GW}}}} {{Methods}}},
Volume = {12},
Year = {2016},
Bdsk-Url-1 = {https://doi.org/10.1021/acs.jctc.5b00871}}
@article{Maggio_2017,
Author = {Maggio, Emanuele and Liu, Peitao and {van Setten}, Michiel J. and Kresse, Georg},
Date-Added = {2018-04-22 16:22:34 +0000},
Date-Modified = {2018-04-22 16:22:34 +0000},
Doi = {10.1021/acs.jctc.6b01150},
Issn = {1549-9618, 1549-9626},
Journal = {J. Chem. Theory Comput.},
Language = {en},
Month = feb,
Number = {2},
Pages = {635-648},
Shorttitle = {{{{\emph{GW}}}} 100},
Title = {{{{\emph{GW}}}} 100: {{A Plane Wave Perspective}} for {{Small Molecules}}},
Volume = {13},
Year = {2017},
Bdsk-Url-1 = {https://doi.org/10.1021/acs.jctc.6b01150}}
@article{Richard_2016,
Author = {Richard, Ryan M. and Marshall, Michael S. and Dolgounitcheva, O. and Ortiz, J. V. and Br{\'e}das, Jean-Luc and Marom, Noa and Sherrill, C. David},
Date-Added = {2018-04-22 16:22:34 +0000},
Date-Modified = {2018-04-22 16:22:34 +0000},
Doi = {10.1021/acs.jctc.5b00875},
Issn = {1549-9618, 1549-9626},
Journal = {J. Chem. Theory Comput.},
Language = {en},
Month = feb,
Number = {2},
Pages = {595-604},
Title = {Accurate {{Ionization Potentials}} and {{Electron Affinities}} of {{Acceptor Molecules I}}. {{Reference Data}} at the {{CCSD}}({{T}}) {{Complete Basis Set Limit}}},
Volume = {12},
Year = {2016},
Bdsk-Url-1 = {https://doi.org/10.1021/acs.jctc.5b00875}}
@article{Rusakov_2014,
Author = {Rusakov, Alexander A. and Phillips, Jordan J. and Zgid, Dominika},
Date-Added = {2018-04-22 16:22:34 +0000},
Date-Modified = {2018-04-22 16:22:34 +0000},
Doi = {10.1063/1.4901432},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = nov,
Number = {19},
Pages = {194105},
Title = {Local {{Hamiltonians}} for Quantitative {{Green}}'s Function Embedding Methods},
Volume = {141},
Year = {2014},
Bdsk-Url-1 = {https://doi.org/10.1063/1.4901432}}
@article{Baym_1961,
Author = {Baym, Gordon and Kadanoff, Leo P.},
Date-Added = {2018-04-21 09:30:30 +0000},
Date-Modified = {2018-04-21 09:30:30 +0000},
Doi = {10.1103/PhysRev.124.287},
Issn = {0031-899X},
Journal = {Phys. Rev.},
Language = {en},
Month = oct,
Number = {2},
Pages = {287--299},
Title = {Conservation {{Laws}} and {{Correlation Functions}}},
Volume = {124},
Year = {1961},
Bdsk-Url-1 = {https://doi.org/10.1103/PhysRev.124.287}}
@article{Baym_1962,
Author = {Baym, Gordon},
Date-Added = {2018-04-21 09:30:30 +0000},
Date-Modified = {2018-04-21 09:30:44 +0000},
Doi = {10.1103/PhysRev.127.1391},
Issn = {0031-899X},
Journal = {Phys. Rev.},
Language = {en},
Month = aug,
Number = {4},
Pages = {1391--1401},
Title = {Self-{{Consistent Approximations}} in {{Many}}-{{Body Systems}}},
Volume = {127},
Year = {1962},
Bdsk-Url-1 = {https://doi.org/10.1103/PhysRev.127.1391}}
@article{Martin_1959,
Author = {Martin, Paul C. and Schwinger, Julian},
Date-Added = {2018-04-21 09:30:30 +0000},
Date-Modified = {2018-04-21 09:30:30 +0000},
Doi = {10.1103/PhysRev.115.1342},
Issn = {0031-899X},
Journal = {Phys. Rev.},
Language = {en},
Month = sep,
Number = {6},
Pages = {1342--1373},
Title = {Theory of {{Many}}-{{Particle Systems}}. {{I}}},
Volume = {115},
Year = {1959},
Bdsk-Url-1 = {https://doi.org/10.1103/PhysRev.115.1342}}
@book{FetterBook,
Author = {A. L. Fetter and J. D. Waleck},
Date-Added = {2018-04-21 09:25:00 +0000},
Date-Modified = {2018-04-21 09:25:48 +0000},
Publisher = {McGraw Hill, San Francisco},
Title = {Quantum Theory of Many Particle Systems},
Year = {1971}}
@article{Luttinger_1960,
Author = {Luttinger, J. M. and Ward, J. C.},
Date-Added = {2018-03-12 11:16:46 +0000},
Date-Modified = {2018-03-12 11:16:46 +0000},
Doi = {10.1103/PhysRev.118.1417},
Issn = {0031-899X},
Journal = {Physical Review},
Language = {en},
Month = jun,
Number = {5},
Pages = {1417--1427},
Title = {Ground-{State} {Energy} of a {Many}-{Fermion} {System}. {II}},
Url = {https://link.aps.org/doi/10.1103/PhysRev.118.1417},
Urldate = {2018-03-12},
Volume = {118},
Year = {1960},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRev.118.1417},
Bdsk-Url-2 = {https://dx.doi.org/10.1103/PhysRev.118.1417}}
@article{Ren_2012,
Author = {Ren, Xinguo and Rinke, Patrick and Joas, Christian and Scheffler, Matthias},
Date-Added = {2018-03-08 21:19:25 +0000},
Date-Modified = {2018-03-08 21:19:25 +0000},
Doi = {10.1007/s10853-012-6570-4},
Issn = {0022-2461, 1573-4803},
Journal = {J. Mater. Sci.},
Language = {en},
Month = nov,
Number = {21},
Pages = {7447--7471},
Title = {Random-Phase Approximation and Its Applications in Computational Chemistry and Materials Science},
Volume = {47},
Year = {2012},
Bdsk-Url-1 = {https://dx.doi.org/10.1007/s10853-012-6570-4}}
@article{Wetherell_2018,
Author = {Wetherell, J. and Hodgson, M. J. P. and Godby, R. W.},
Date-Added = {2018-03-08 21:16:56 +0000},
Date-Modified = {2018-04-14 07:32:38 +0000},
Doi = {10.1103/PhysRevB.97.121102},
Issn = {2469-9950, 2469-9969},
Journal = {Phys. Rev. B},
Language = {en},
Month = mar,
Number = {12},
Pages = {121102},
Title = {G {{W}} Self-Screening Error and Its Correction Using a Local Density Functional},
Volume = {97},
Year = {2018},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.97.121102}}
@article{Aryasetiawan_2012,
Author = {Aryasetiawan, F. and Sakuma, R. and Karlsson, K.},
Date-Added = {2018-03-06 20:22:33 +0000},
Date-Modified = {2018-04-14 07:25:24 +0000},
Doi = {10.1103/PhysRevB.85.035106},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = jan,
Number = {3},
Pages = {035106},
Title = {G {{W}} Approximation with Self-Screening Correction},
Volume = {85},
Year = {2012},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.85.035106}}
@book{Martin_2016,
Abstract = {"Recent progress in the theory and computation of electronic structure is bringing an unprecedented level of capability for research. Many-body methods are becoming essential tools vital for quantitative calculations and understanding materials phenomena in physics, chemistry, materials science and other fields. This book provides a unified exposition of the most-used tools: many-body perturbation theory, dynamical mean field theory and quantum Monte Carlo simulations. Each topic is introduced with a less technical overview for a broad readership, followed by in-depth descriptions and mathematical formulation"--},
Address = {New York, NY},
Author = {Martin, Richard M. and Reining, Lucia and Ceperley, David},
Date-Added = {2018-03-06 19:42:15 +0000},
Date-Modified = {2018-03-06 19:42:15 +0000},
Isbn = {978-0-521-87150-1},
Keywords = {Electronic structure,Electrons,Many-body problem,Monte Carlo method,Perturbation (Quantum dynamics),Quantum theory},
Lccn = {QC176.8.E4 M368 2016},
Publisher = {{Cambridge University Press}},
Shorttitle = {Interacting Electrons},
Title = {Interacting Electrons: Theory and Computational Approaches},
Year = {2016}}
@article{Phillips_2014,
Author = {Phillips, Jordan J. and Zgid, Dominika},
Date-Added = {2018-03-06 19:42:15 +0000},
Date-Modified = {2018-03-06 19:42:15 +0000},
Doi = {10.1063/1.4884951},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = jun,
Number = {24},
Pages = {241101},
Shorttitle = {Communication},
Title = {Communication: {{The}} Description of Strong Correlation within Self-Consistent {{Green}}'s Function Second-Order Perturbation Theory},
Volume = {140},
Year = {2014},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.4884951}}
@article{Phillips_2015,
Author = {Phillips, Jordan J. and Kananenka, Alexei A. and Zgid, Dominika},
Date-Added = {2018-03-06 19:42:15 +0000},
Date-Modified = {2018-03-06 19:42:15 +0000},
Doi = {10.1063/1.4921259},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = may,
Number = {19},
Pages = {194108},
Title = {Fractional Charge and Spin Errors in Self-Consistent {{Green}}'s Function Theory},
Volume = {142},
Year = {2015},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.4921259}}
@article{Rusakov_2016,
Author = {Rusakov, Alexander A. and Zgid, Dominika},
Date-Added = {2018-03-06 19:42:15 +0000},
Date-Modified = {2018-03-06 19:42:15 +0000},
Doi = {10.1063/1.4940900},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = feb,
Number = {5},
Pages = {054106},
Title = {Self-Consistent Second-Order {{Green}}'s Function Perturbation Theory for Periodic Systems},
Volume = {144},
Year = {2016},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.4940900}}
@book{Stefanucci_2013,
Abstract = {"The Green's function method is one of the most powerful and versatile formalisms in physics, and its nonequilibrium version has proved invaluable in many research fields. This book provides a unique, self-contained introduction to nonequilibrium many-body theory. Starting with basic quantum mechanics, the authors introduce the equilibrium and nonequilibrium Green's function formalisms within a unified framework called the contour formalism. The physical content of the contour Green's functions and the diagrammatic expansions are explained with a focus on the time-dependent aspect. Every result is derived step-by-step, critically discussed and then applied to different physical systems, ranging from molecules and nanostructures to metals and insulators. With an abundance of illustrative examples, this accessible book is ideal for graduate students and researchers who are interested in excited state properties of matter and nonequilibrium physics"--},
Address = {Cambridge},
Author = {Stefanucci, Gianluca and van Leeuwen, Robert},
Date-Added = {2018-03-06 19:42:15 +0000},
Date-Modified = {2018-03-06 19:42:15 +0000},
Isbn = {978-0-521-76617-3},
Keywords = {Many-body problem,Quantum theory,Green's functions,Mathematics,SCIENCE / Physics},
Lccn = {QC174.17.G68 S74 2013},
Publisher = {{Cambridge University Press}},
Shorttitle = {Nonequilibrium Many-Body Theory of Quantum Systems},
Title = {Nonequilibrium Many-Body Theory of Quantum Systems: A Modern Introduction},
Year = {2013}}
@article{Strinati_1988,
Author = {Strinati, G.},
Date-Added = {2018-03-06 19:42:15 +0000},
Date-Modified = {2018-03-06 19:42:15 +0000},
Doi = {10.1007/BF02725962},
Issn = {1826-9850},
Journal = {Riv. Nuovo Cimento},
Language = {en},
Month = dec,
Number = {12},
Pages = {1--86},
Title = {Application of the {{Green}}'s Functions Method to the Study of the Optical Properties of Semiconductors},
Volume = {11},
Year = {1988},
Bdsk-Url-1 = {https://dx.doi.org/10.1007/BF02725962}}
@article{vonBarth_1996,
Author = {{von Barth}, Ulf and Holm, Bengt},
Date-Added = {2018-03-06 19:42:15 +0000},
Date-Modified = {2018-07-05 09:37:45 +0000},
Doi = {10.1103/PhysRevB.54.8411},
File = {/Users/loos/Zotero/storage/QZN2CFQX/vonBarth_1996.pdf},
Journal = {Phys. Rev. B},
Number = {12},
Pages = {8411},
Shorttitle = {Self-Consistent {{GW}} 0 Results for the Electron Gas},
Title = {Self-Consistent {{GW}} 0 Results for the Electron Gas: {{Fixed}} Screened Potential {{W}} 0 within the Random-Phase Approximation},
Volume = {54},
Year = {1996},
Bdsk-Url-1 = {https://doi.org/10.1103/PhysRevB.54.8411}}
@article{Casida_1989,
Author = {Casida, Mark E. and Chong, Delano P.},
Date-Added = {2018-03-03 16:36:07 +0000},
Date-Modified = {2018-07-18 13:20:19 +0000},
Doi = {10.1103/PhysRevA.40.4837},
File = {/Users/loos/Zotero/storage/Q9SZH8DT/Casida_1989.pdf},
Journal = {Phys. Rev. A},
Number = {9},
Pages = {4837--4848},
Title = {Physical Interpretation and Assessment of the {{Coulomb}}-Hole and Screened-Exchange Approximation for Molecules},
Volume = {40},
Year = {1989},
Bdsk-Url-1 = {https://doi.org/10.1103/PhysRevA.40.4837}}
@article{Casida_1991,
Author = {Casida, Mark E. and Chong, Delano P.},
Date-Added = {2018-03-03 16:36:07 +0000},
Date-Modified = {2018-07-18 13:19:04 +0000},
Doi = {10.1103/PhysRevA.44.5773},
File = {/Users/loos/Zotero/storage/56Z844J7/Casida_1991a.pdf},
Journal = {Phys. Rev. A},
Number = {9},
Pages = {5773--5783},
Shorttitle = {Simplified {{Green}}-Function Approximations},
Title = {Simplified {{Green}}-Function Approximations: {{Further}} Assessment of a Polarization Model for Second-Order Calculation of Outer-Valence Ionization Potentials in Molecules},
Volume = {44},
Year = {1991},
Bdsk-Url-1 = {https://doi.org/10.1103/PhysRevA.44.5773}}
@article{Casida_1991a,
Author = {Casida, Mark E. and Chong, Delano P.},
Date-Added = {2018-03-03 16:36:07 +0000},
Date-Modified = {2018-07-18 13:19:44 +0000},
Doi = {10.1002/qua.560400206},
File = {/Users/loos/Zotero/storage/XHIUNWXB/Casida_1991b.pdf},
Journal = {Int. J. Quantum Chem.},
Number = {2},
Pages = {225--242},
Title = {Quasi-Particle Equation from the Configuration-Interaction ({{CI}}) Wave-Function Method},
Volume = {40},
Year = {1991},
Bdsk-Url-1 = {https://doi.org/10.1002/qua.560400206}}
@article{Friedrich_2006a,
Author = {Friedrich, Christoph and Schindlmayr, Arno and Bl{\"u}gel, Stefan and Kotani, Takao},
Date-Added = {2018-03-03 16:36:07 +0000},
Date-Modified = {2018-04-14 07:26:06 +0000},
Doi = {10.1103/PhysRevB.74.045104},
File = {/Users/loos/Zotero/storage/E7JYZIM2/Friedrich_2006.pdf},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = jul,
Number = {4},
Pages = {045104},
Title = {Elimination of the Linearization Error in {{{\emph{GW}}}} Calculations Based on the Linearized Augmented-Plane-Wave Method},
Volume = {74},
Year = {2006},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.74.045104}}
@article{Hernandez_1977,
Author = {Hern{\'a}ndez, A. J. and Langhoff, P. W.},
Date-Added = {2018-03-03 16:36:07 +0000},
Date-Modified = {2018-03-03 16:36:07 +0000},
File = {/Users/loos/Zotero/storage/XEF84BE7/Hernandez_1977.pdf},
Journal = {Chem. Phys. Lett.},
Number = {3},
Pages = {421--426},
Title = {On {{Rayleigh}}-{{Schr{\"o}dinger}} and Green's-Function Calculations of Ionization Potentials and Electron Affinities},
Volume = {49},
Year = {1977}}
@article{Schone_1998a,
Author = {Sch{\"o}ne, Wolf-Dieter and Eguiluz, Adolfo G.},
Date-Added = {2018-03-03 16:36:07 +0000},
Date-Modified = {2018-03-03 16:36:07 +0000},
File = {/Users/loos/Zotero/storage/J4XS8Z9Q/Schone_1998.pdf},
Journal = {Phys. Rev. Lett.},
Number = {8},
Pages = {1662},
Title = {Self-Consistent Calculations of Quasiparticle States in Metals and Semiconductors},
Volume = {81},
Year = {1998}}
@article{Pulay_1980,
Author = {Pulay, P{\'e}ter},
Date-Added = {2018-02-25 19:37:56 +0000},
Date-Modified = {2018-02-25 19:37:56 +0000},
Doi = {10.1016/0009-2614(80)80396-4},
Issn = {00092614},
Journal = {Chem. Phys. Lett.},
Language = {en},
Month = jul,
Number = {2},
Pages = {393--398},
Title = {Convergence Acceleration of Iterative Sequences. the Case of Scf Iteration},
Volume = {73},
Year = {1980},
Bdsk-Url-1 = {https://dx.doi.org/10.1016/0009-2614(80)80396-4}}
@article{Pulay_1982,
Author = {Pulay, P.},
Date-Added = {2018-02-25 19:37:56 +0000},
Date-Modified = {2018-02-25 19:37:56 +0000},
Doi = {10.1002/jcc.540030413},
Issn = {0192-8651, 1096-987X},
Journal = {J. Comput. Chem.},
Language = {en},
Number = {4},
Pages = {556--560},
Title = {{{ImprovedSCF}} Convergence Acceleration},
Volume = {3},
Year = {1982},
Bdsk-Url-1 = {https://dx.doi.org/10.1002/jcc.540030413}}
@article{Berger_2014a,
Author = {Berger, J A and Romaniello, Pina and Tandetzky, Falk and Mendoza, Bernardo S and Brouder, Christian and Reining, Lucia},
Date-Added = {2018-02-25 15:53:21 +0000},
Date-Modified = {2018-02-25 15:53:21 +0000},
Doi = {10.1088/1367-2630/16/11/113025},
Issn = {1367-2630},
Journal = {New J. Phys.},
Month = nov,
Number = {11},
Pages = {113025},
Title = {Solution to the Many-Body Problem in One Point},
Volume = {16},
Year = {2014},
Bdsk-Url-1 = {https://dx.doi.org/10.1088/1367-2630/16/11/113025}}
@article{Casida_1995,
Author = {Casida, Mark E.},
Date-Added = {2018-02-24 22:54:58 +0000},
Date-Modified = {2018-02-24 22:54:58 +0000},
Doi = {10.1103/PhysRevA.51.2005},
Issn = {1050-2947, 1094-1622},
Journal = {Phys. Rev. A},
Language = {en},
Month = mar,
Number = {3},
Pages = {2005--2013},
Shorttitle = {Generalization of the Optimized-Effective-Potential Model to Include Electron Correlation},
Title = {Generalization of the Optimized-Effective-Potential Model to Include Electron Correlation: {{A}} Variational Derivation of the {{Sham}}-{{Schl{\"u}ter}} Equation for the Exact Exchange-Correlation Potential},
Volume = {51},
Year = {1995},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevA.51.2005}}
@article{Holm_1999,
Author = {Holm, Bengt},
Date-Added = {2018-02-24 22:54:58 +0000},
Date-Modified = {2018-02-24 22:54:58 +0000},
Doi = {10.1103/PhysRevLett.83.788},
Issn = {0031-9007, 1079-7114},
Journal = {Phys. Rev. Lett.},
Language = {en},
Month = jul,
Number = {4},
Pages = {788--791},
Title = {Total {{Energies}} from {{GW Calculations}}},
Volume = {83},
Year = {1999},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevLett.83.788}}
@book{SzaboBook,
Address = {New York},
Author = {A. Szabo and N. S. Ostlund},
Date-Added = {2018-02-24 21:04:21 +0000},
Date-Modified = {2018-02-24 21:04:21 +0000},
Keywords = {qmech},
Publisher = {McGraw-Hill},
Title = {Modern quantum chemistry},
Year = {1989}}
@article{Faber_2011,
Author = {Faber, Carina and Attaccalite, Claudio and Olevano, V. and Runge, E. and Blase, X.},
Date-Added = {2018-02-24 20:47:47 +0000},
Date-Modified = {2018-04-14 07:19:37 +0000},
Doi = {10.1103/PhysRevB.83.115123},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = mar,
Number = {11},
Pages = {115123},
Title = {First-Principles {{GW}} Calculations for {{DNA}} and {{RNA}} Nucleobases},
Volume = {83},
Year = {2011},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.83.115123}}
@incollection{Hedin_1970,
Author = {Hedin, Lars and Lundqvist, Stig},
Booktitle = {Solid State Physics},
Date-Added = {2018-02-24 19:55:02 +0000},
Date-Modified = {2018-02-24 19:57:12 +0000},
Doi = {10.1016/S0081-1947(08)60615-3},
Isbn = {978-0-12-607723-0},
Language = {en},
Pages = {1--181},
Publisher = {Elsevier},
Title = {Effects of Electron-Electron and Electron-Phonon Interactions on the One-Electron States of Solids},
Volume = {23},
Year = {1970},
Bdsk-Url-1 = {https://dx.doi.org/10.1016/S0081-1947(08)60615-3}}
@article{Hybertsen_1986,
Author = {Hybertsen, Mark S. and Louie, Steven G.},
Date-Added = {2018-02-24 19:55:02 +0000},
Date-Modified = {2018-02-24 19:55:02 +0000},
Doi = {10.1103/PhysRevB.34.5390},
Issn = {0163-1829},
Journal = {Phys. Rev. B},
Language = {en},
Month = oct,
Number = {8},
Pages = {5390--5413},
Shorttitle = {Electron Correlation in Semiconductors and Insulators},
Title = {Electron Correlation in Semiconductors and Insulators: {{Band}} Gaps and Quasiparticle Energies},
Volume = {34},
Year = {1986},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.34.5390}}
@article{Hybertsen_1985a,
Author = {Hybertsen, Mark S. and Louie, Steven G.},
Date-Added = {2018-02-24 19:55:02 +0000},
Date-Modified = {2018-02-24 19:55:02 +0000},
Doi = {10.1103/PhysRevLett.55.1418},
Issn = {0031-9007},
Journal = {Phys. Rev. Lett.},
Language = {en},
Month = sep,
Number = {13},
Pages = {1418--1421},
Shorttitle = {First-{{Principles Theory}} of {{Quasiparticles}}},
Title = {First-{{Principles Theory}} of {{Quasiparticles}}: {{Calculation}} of {{Band Gaps}} in {{Semiconductors}} and {{Insulators}}},
Volume = {55},
Year = {1985},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevLett.55.1418}}
@article{Friedrich_2006,
Author = {Friedrich, Christoph and Schindlmayr, Arno and Bl{\"u}gel, Stefan and Kotani, Takao},
Date-Added = {2018-02-24 19:51:02 +0000},
Date-Modified = {2018-04-14 07:25:57 +0000},
Doi = {10.1103/PhysRevB.74.045104},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = jul,
Number = {4},
Pages = {045104},
Title = {Elimination of the Linearization Error in {{{\emph{GW}}}} Calculations Based on the Linearized Augmented-Plane-Wave Method},
Volume = {74},
Year = {2006},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.74.045104}}
@article{Klein_1961,
Author = {Klein, Abraham},
Date-Added = {2018-02-24 19:51:02 +0000},
Date-Modified = {2018-02-24 19:51:02 +0000},
Doi = {10.1103/PhysRev.121.950},
Issn = {0031-899X},
Journal = {Phys. Rev.},
Language = {en},
Month = feb,
Number = {4},
Pages = {950--956},
Title = {Perturbation {{Theory}} for an {{Infinite Medium}} of {{Fermions}}. {{II}}},
Volume = {121},
Year = {1961},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRev.121.950}}
@article{Schone_1998,
Author = {Sch{\"o}ne, Wolf-Dieter and Eguiluz, Adolfo G.},
Date-Added = {2018-02-24 19:51:02 +0000},
Date-Modified = {2018-02-24 19:51:02 +0000},
Doi = {10.1103/PhysRevLett.81.1662},
Issn = {0031-9007, 1079-7114},
Journal = {Phys. Rev. Lett.},
Language = {en},
Month = aug,
Number = {8},
Pages = {1662--1665},
Title = {Self-{{Consistent Calculations}} of {{Quasiparticle States}} in {{Metals}} and {{Semiconductors}}},
Volume = {81},
Year = {1998},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevLett.81.1662}}
@article{deGroot_1995,
Author = {{de Groot}, H. J. and Bobbert, P. A. and {van Haeringen}, W.},
Date-Added = {2018-02-24 19:51:02 +0000},
Date-Modified = {2018-02-24 19:51:02 +0000},
Doi = {10.1103/PhysRevB.52.11000},
Issn = {0163-1829, 1095-3795},
Journal = {Phys. Rev. B},
Language = {en},
Month = oct,
Number = {15},
Pages = {11000--11007},
Title = {Self-Consistent {{{\emph{GW}}}} for a Quasi-One-Dimensional Semiconductor},
Volume = {52},
Year = {1995},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.52.11000}}
@article{Galitskii_1958,
Author = {V. Galitskii and A. Migdal},
Date-Added = {2018-02-24 19:47:40 +0000},
Date-Modified = {2018-02-24 19:48:36 +0000},
Journal = {Sov. Phys. JETP},
Pages = {96},
Volume = {7},
Year = {1958}}
@book{NISTbook,
Address = {New York},
Date-Added = {2018-02-24 19:02:50 +0000},
Date-Modified = {2018-02-24 19:02:50 +0000},
Editor = {F. W. J. Olver and D. W. Lozier and R. F. Boisvert and C. W. Clark},
Keywords = {maths},
Publisher = {Cambridge University Press},
Title = {NIST Handbook of Mathematical Functions},
Year = {2010}}
@article{Seidl_2007,
Author = {Seidl, Michael},
Date-Added = {2018-02-24 13:48:36 +0000},
Date-Modified = {2018-04-14 07:29:55 +0000},
Doi = {10.1103/PhysRevA.75.062506},
Issn = {1050-2947, 1094-1622},
Journal = {Phys. Rev. A},
Language = {en},
Month = jun,
Number = {6},
Pages = {062506},
Shorttitle = {Adiabatic Connection in Density-Functional Theory},
Title = {Adiabatic Connection in Density-Functional Theory: {{Two}} Electrons on the Surface of a Sphere},
Volume = {75},
Year = {2007},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevA.75.062506}}
@article{Loos_2010e,
Author = {Loos, Pierre-Fran{\c c}ois and Gill, Peter M.W.},
Date-Added = {2018-02-24 13:46:12 +0000},
Date-Modified = {2018-02-24 13:46:12 +0000},
Doi = {10.1080/00268976.2010.508472},
File = {/Users/loos/Zotero/storage/TLWJZ3HQ/25.pdf},
Issn = {0026-8976, 1362-3028},
Journal = {Mol. Phys.},
Language = {en},
Month = oct,
Number = {19-20},
Pages = {2527--2532},
Title = {Excited States of Spherium},
Volume = {108},
Year = {2010},
Bdsk-Url-1 = {https://dx.doi.org/10.1080/00268976.2010.508472}}
@article{Loos_2017a,
Author = {Loos, Pierre-Fran{\c c}ois},
Date-Added = {2018-02-24 13:46:12 +0000},
Date-Modified = {2018-02-24 13:46:12 +0000},
Doi = {10.1063/1.4978409},
File = {/Users/loos/Zotero/storage/NJ3WTVZZ/54.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = mar,
Number = {11},
Pages = {114108},
Title = {Exchange Functionals Based on Finite Uniform Electron Gases},
Volume = {146},
Year = {2017},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.4978409}}
@article{Onida_2002,
Author = {G. Onida and L. Reining and A. Rubio and},
Date-Added = {2018-02-24 13:00:32 +0000},
Date-Modified = {2018-07-05 09:48:14 +0000},
Doi = {10.1103/RevModPhys.74.601},
Journal = {Rev. Mod. Phys.},
Pages = {601--659},
Title = {Electronic excitations: density-functional versus many-body Green's-function approaches},
Volume = {74},
Year = {2002},
Bdsk-Url-1 = {https://doi.org/10.1103/RevModPhys.74.601}}
@article{Aryasetiawan_1998,
Author = {F. Aryasetiawan and O. Gunnarsson},
Date-Added = {2018-02-24 12:59:01 +0000},
Date-Modified = {2018-07-05 09:40:02 +0000},
Doi = {10.1088/0034-4885/61/3/002},
Journal = {Rep. Prog. Phys.},
Pages = {237--312},
Title = {The GW method},
Volume = {61},
Year = {1998},
Bdsk-Url-1 = {https://doi.org/10.1088/0034-4885/61/3/002}}
@article{Agboola_2015,
Author = {Agboola, Davids and Knol, Anneke L. and Gill, Peter M. W. and Loos, Pierre-Fran{\c c}ois},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1063/1.4929353},
File = {/Users/loos/Zotero/storage/YFD785CA/46.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = aug,
Number = {8},
Pages = {084114},
Title = {Uniform Electron Gases. {{III}}. {{Low}}-Density Gases on Three-Dimensional Spheres},
Volume = {143},
Year = {2015},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.4929353}}
@article{Ambrosek_2010,
Author = {Ambrosek, David and Loos, Pierre-Fran{\c c}ois and Assfeld, Xavier and Daniel, Chantal},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1016/j.jinorgbio.2010.04.002},
File = {/Users/loos/Zotero/storage/WA85FMNN/22.pdf},
Issn = {01620134},
Journal = {Journal of Inorganic Biochemistry},
Language = {en},
Month = sep,
Number = {9},
Pages = {893--901},
Title = {A Theoretical Study of {{Ru}}({{II}}) Polypyridyl {{DNA intercalatorsStructure}} and Electronic Absorption Spectroscopy of [{{Ru}}(Phen)2(Dppz)]2+ and [{{Ru}}(Tap)2(Dppz)]2+ Complexes Intercalated in Guanine\textendash{}cytosine Base Pairs},
Volume = {104},
Year = {2010},
Bdsk-Url-1 = {https://dx.doi.org/10.1016/j.jinorgbio.2010.04.002}}
@article{Ball_2017,
Author = {Ball, Caleb J. and Loos, Pierre-Fran{\c c}ois and Gill, Peter M. W.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1039/C6CP06801D},
File = {/Users/loos/Zotero/storage/7X5YE6WH/52.pdf},
Issn = {1463-9076, 1463-9084},
Journal = {Physical Chemistry Chemical Physics},
Language = {en},
Number = {5},
Pages = {3987--3998},
Title = {Molecular Electronic Structure in One-Dimensional {{Coulomb}} Systems},
Volume = {19},
Year = {2017},
Bdsk-Url-1 = {https://dx.doi.org/10.1039/C6CP06801D}}
@article{Barca_2016,
Author = {Barca, Giuseppe M. J. and Loos, Pierre-Fran{\c c}ois and Gill, Peter M. W.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1021/acs.jctc.6b00130},
File = {/Users/loos/Zotero/storage/JS793AVF/49.pdf},
Issn = {1549-9618, 1549-9626},
Journal = {Journal of Chemical Theory and Computation},
Language = {en},
Month = apr,
Number = {4},
Pages = {1735--1740},
Title = {Many-{{Electron Integrals}} over {{Gaussian Basis Functions}}. {{I}}. {{Recurrence Relations}} for {{Three}}-{{Electron Integrals}}},
Volume = {12},
Year = {2016},
Bdsk-Url-1 = {https://dx.doi.org/10.1021/acs.jctc.6b00130}}
@article{Barca_2017,
Author = {Barca, Giuseppe MJ and Loos, Pierre-Fran{\c c}ois},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
File = {/Users/loos/Zotero/storage/DCFUMHWZ/56.pdf},
Journal = {The Journal of chemical physics},
Number = {2},
Pages = {024103},
Shorttitle = {Three-and Four-Electron Integrals Involving {{Gaussian}} Geminals},
Title = {Three-and Four-Electron Integrals Involving {{Gaussian}} Geminals: {{Fundamental}} Integrals, Upper Bounds, and Recurrence Relations},
Volume = {147},
Year = {2017}}
@incollection{Barca_2018,
Author = {Barca, Giuseppe M.J. and Loos, Pierre-Fran{\c c}ois},
Booktitle = {Advances in {{Quantum Chemistry}}},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1016/bs.aiq.2017.03.004},
File = {/Users/loos/Zotero/storage/JQKXB9RU/58.pdf},
Isbn = {978-0-12-813002-5},
Language = {en},
Pages = {147--165},
Publisher = {{Elsevier}},
Title = {Recurrence {{Relations}} for {{Four}}-{{Electron Integrals Over Gaussian Basis Functions}}},
Volume = {76},
Year = {2018},
Bdsk-Url-1 = {https://dx.doi.org/10.1016/bs.aiq.2017.03.004}}
@article{Bernard_2013,
Author = {Bernard, Yves A. and Loos, Pierre-Fran{\c c}ois and Gill, Peter M.W.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1080/00268976.2013.811302},
File = {/Users/loos/Zotero/storage/8XRA54GV/39.pdf},
Issn = {0026-8976, 1362-3028},
Journal = {Mol. Phys.},
Language = {en},
Month = sep,
Number = {16-17},
Pages = {2414--2426},
Title = {Distribution of r {\textsubscript{12}} $\cdot$ p {\textsubscript{12}} in Quantum Systems},
Volume = {111},
Year = {2013},
Bdsk-Url-1 = {https://dx.doi.org/10.1080/00268976.2013.811302}}
@article{Dumont_2008,
Author = {Dumont, {\'E}lise and Loos, Pierre-Fran{\c c}ois and Assfeld, Xavier},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1016/j.cplett.2008.05.010},
File = {/Users/loos/Zotero/storage/5Q5WP253/12.pdf},
Issn = {00092614},
Journal = {Chem. Phys. Lett.},
Language = {en},
Month = jun,
Number = {4-6},
Pages = {276--280},
Title = {Effect of Ring Strain on Disulfide Electron Attachment},
Volume = {458},
Year = {2008},
Bdsk-Url-1 = {https://dx.doi.org/10.1016/j.cplett.2008.05.010}}
@article{Dumont_2008a,
Author = {Dumont, {\'E}lise and Loos, Pierre-Fran{\c c}ois and Assfeld, Xavier},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1021/jp806465e},
File = {/Users/loos/Zotero/storage/5FHSI4FF/14.pdf},
Issn = {1520-6106, 1520-5207},
Journal = {The Journal of Physical Chemistry B},
Language = {en},
Month = oct,
Number = {43},
Pages = {13661--13669},
Title = {Factors {{Governing Electron Capture}} by {{Small Disulfide Loops}} in {{Two}}-{{Cysteine Peptides}}},
Volume = {112},
Year = {2008},
Bdsk-Url-1 = {https://dx.doi.org/10.1021/jp806465e}}
@article{Dumont_2008b,
Author = {Dumont, Elise and Loos, Pierre-Fran{\c c}ois and Laurent, Ad{\`e}le D. and Assfeld, Xavier},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1021/ct800161m},
File = {/Users/loos/Zotero/storage/AU5GAG48/13.pdf},
Issn = {1549-9618, 1549-9626},
Journal = {Journal of Chemical Theory and Computation},
Language = {en},
Month = aug,
Number = {8},
Pages = {1171--1173},
Title = {Huge {{Disulfide}}-{{Linkage}}'{{S Electron Capture Variation Induced}} by $\alpha$-{{Helix Orientation}}},
Volume = {4},
Year = {2008},
Bdsk-Url-1 = {https://dx.doi.org/10.1021/ct800161m}}
@article{Dumont_2009,
Author = {Dumont, {\'E}lise and Laurent, Ad{\`e}le D. and Loos, Pierre-Fran{\c c}ois and Assfeld, Xavier},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1021/ct900093h},
File = {/Users/loos/Zotero/storage/DXBEWEYC/15.pdf},
Issn = {1549-9618, 1549-9626},
Journal = {Journal of Chemical Theory and Computation},
Language = {en},
Month = jun,
Number = {6},
Pages = {1700--1708},
Title = {Analyzing the {{Selectivity}} and {{Successiveness}} of a {{Two}}-{{Electron Capture}} on a {{Multiply Disulfide}}-{{Linked Protein}}},
Volume = {5},
Year = {2009},
Bdsk-Url-1 = {https://dx.doi.org/10.1021/ct900093h}}
@article{Dumont_2010,
Author = {Dumont, {\~A}‰lise and Loos, Pierre-Fran{\~A}\textsection{}ois and Laurent, Ad{\~A}\textasciidieresis{}le D. and Assfeld, Xavier},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1002/qua.22072},
File = {/Users/loos/Zotero/storage/4VG63LZM/20.pdf},
Issn = {00207608, 1097461X},
Journal = {Int. J. Quantum Chem.},
Language = {en},
Month = mar,
Number = {3},
Pages = {513--523},
Title = {Electronic Effects and Ring Strain Influences on the Electron Uptake by Selenium-Containing Bonds},
Volume = {110},
Year = {2010},
Bdsk-Url-1 = {https://dx.doi.org/10.1002/qua.22072}}
@article{Fornili_2006,
Author = {Fornili, Arianna and Loos, Pierre-Fran{\c c}ois and Sironi, Maurizio and Assfeld, Xavier},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1016/j.cplett.2006.06.095},
File = {/Users/loos/Zotero/storage/28RWJAZ8/2.pdf},
Issn = {00092614},
Journal = {Chem. Phys. Lett.},
Language = {en},
Month = aug,
Number = {1-3},
Pages = {236--240},
Title = {Frozen Core Orbitals as an Alternative to Specific Frontier Bond Potential in Hybrid {{Quantum Mechanics}}/{{Molecular Mechanics}} Methods},
Volume = {427},
Year = {2006},
Bdsk-Url-1 = {https://dx.doi.org/10.1016/j.cplett.2006.06.095}}
@article{Garniron_2017,
Author = {Garniron, Yann and Scemama, Anthony and Loos, Pierre-Fran{\c c}ois and Caffarel, Michel},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1063/1.4992127},
File = {/Users/loos/Zotero/storage/NHU2BWMZ/57.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = jul,
Number = {3},
Pages = {034101},
Title = {Hybrid Stochastic-Deterministic Calculation of the Second-Order Perturbative Contribution of Multireference Perturbation Theory},
Volume = {147},
Year = {2017},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.4992127}}
@article{Gill_2012,
Author = {Gill, Peter M. W. and Loos, Pierre-Fran{\c c}ois},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-04-14 07:30:52 +0000},
Doi = {10.1007/s00214-011-1069-7},
File = {/Users/loos/Zotero/storage/A85Y7E9B/32.pdf},
Issn = {1432-881X, 1432-2234},
Journal = {Theor. Chem. Acc.},
Language = {en},
Month = jan,
Number = {1},
Pages = {1069},
Title = {Uniform Electron Gases},
Volume = {131},
Year = {2012},
Bdsk-Url-1 = {https://dx.doi.org/10.1007/s00214-011-1069-7}}
@article{Gill_2014,
Author = {Gill, Peter M. W. and Loos, Pierre-Fran{\c c}ois and Agboola, Davids},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1063/1.4903984},
File = {/Users/loos/Zotero/storage/YM5Q8ST9/43.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = dec,
Number = {24},
Pages = {244102},
Title = {Basis Functions for Electronic Structure Calculations on Spheres},
Volume = {141},
Year = {2014},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.4903984}}
@article{Loos_2007,
Author = {Loos, Pierre-Fran{\c c}ois and Assfeld, Xavier},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1002/qua.21410},
File = {/Users/loos/Zotero/storage/64MPU2ZJ/8.pdf},
Issn = {00207608, 1097461X},
Journal = {Int. J. Quantum Chem.},
Language = {en},
Number = {12},
Pages = {2243--2252},
Title = {Core-Ionized and Core-Excited States of Macromolecules},
Volume = {107},
Year = {2007},
Bdsk-Url-1 = {https://dx.doi.org/10.1002/qua.21410}}
@article{Loos_2007a,
Author = {Loos, Pierre-Fran{\c c}ois and Assfeld, Xavier and Rivail, Jean-Louis},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1007/s00214-007-0258-x},
File = {/Users/loos/Zotero/storage/S6FBKP2M/5.pdf},
Issn = {1432-881X, 1432-2234},
Journal = {Theor. Chem. Acc.},
Language = {en},
Month = jun,
Number = {1},
Pages = {165--171},
Title = {Intramolecular Interactions and Cis Peptidic Bonds},
Volume = {118},
Year = {2007},
Bdsk-Url-1 = {https://dx.doi.org/10.1007/s00214-007-0258-x}}
@inproceedings{Loos_2007b,
Author = {Loos, Pierre-Fran{\c c}ois and Assfeld, Xavier},
Booktitle = {{{AIP Conference Proceedings}}},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
File = {/Users/loos/Zotero/storage/HGKGXAMT/10.pdf},
Pages = {308--315},
Publisher = {{AIP}},
Title = {On {{The Frontier Bond Location In The QM}}/{{MM Description Of Peptides And Proteins}}.},
Volume = {963},
Year = {2007}}
@article{Loos_2007c,
Author = {Loos, P.-F. and Fornili, A. and Sironi, M. and Assfeld, X.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
File = {/Users/loos/Zotero/storage/CAHLR8H8/9.pdf},
Journal = {Computing Letters},
Number = {2-4},
Pages = {2--4},
Shorttitle = {Removing Extra Frontier Parameters in {{QM}}/{{MM}} Methods},
Title = {Removing Extra Frontier Parameters in {{QM}}/{{MM}} Methods: A Tentative with the {{Local Self}}-{{Consistent Field}} Approach},
Volume = {3},
Year = {2007}}
@article{Loos_2007d,
Author = {Loos, Pierre-Fran{\c c}ois and Assfeld, Xavier},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1021/ct6003214},
File = {/Users/loos/Zotero/storage/A9TSDVGQ/6.pdf},
Issn = {1549-9618, 1549-9626},
Journal = {Journal of Chemical Theory and Computation},
Language = {en},
Month = may,
Number = {3},
Pages = {1047--1053},
Title = {Self-{{Consistent Strictly Localized Orbitals}}},
Volume = {3},
Year = {2007},
Bdsk-Url-1 = {https://dx.doi.org/10.1021/ct6003214}}
@article{Loos_2008,
Author = {Loos, Pierre-Fran{\c c}ois and Preat, Julien and Laurent, Ad{\`e}le D. and Michaux, Catherine and Jacquemin, Denis and Perp{\`e}te, Eric A. and Assfeld, Xavier},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1021/ct700188w},
File = {/Users/loos/Zotero/storage/LSU72HGK/11.pdf},
Issn = {1549-9618, 1549-9626},
Journal = {Journal of Chemical Theory and Computation},
Language = {en},
Month = apr,
Number = {4},
Pages = {637--645},
Shorttitle = {Theoretical {{Investigation}} of the {{Geometries}} and {{UV}}-vis {{Spectra}} of {{Poly}}( $<$span Style="font-Variant},
Title = {Theoretical {{Investigation}} of the {{Geometries}} and {{UV}}-vis {{Spectra}} of {{Poly}}( {\textsc{l}} -Glutamic Acid) {{Featuring}} a {{Photochromic Azobenzene Side Chain}}},
Volume = {4},
Year = {2008},
Bdsk-Url-1 = {https://dx.doi.org/10.1021/ct700188w}}
@article{Loos_2009,
Author = {Loos, Pierre-Fran{\c c}ois and Gill, Peter M. W.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1063/1.3275519},
File = {/Users/loos/Zotero/storage/E9MV4JCJ/19.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = dec,
Number = {24},
Pages = {241101},
Title = {Correlation Energy of Two Electrons in the High-Density Limit},
Volume = {131},
Year = {2009},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.3275519}}
@article{Loos_2009a,
Author = {Loos, Pierre-Fran{\c c}ois and Gill, Peter M. W.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-04-14 07:27:46 +0000},
Doi = {10.1103/PhysRevA.79.062517},
File = {/Users/loos/Zotero/storage/R9N5FN2F/17.pdf},
Issn = {1050-2947, 1094-1622},
Journal = {Phys. Rev. A},
Language = {en},
Month = jun,
Number = {6},
Pages = {062517},
Title = {Ground State of Two Electrons on a Sphere},
Volume = {79},
Year = {2009},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevA.79.062517}}
@article{Loos_2009b,
Author = {Loos, Pierre-Fran{\c c}ois and Dumont, Elise and Laurent, Ad{\`e}le D. and Assfeld, Xavier},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1016/j.cplett.2009.05.041},
File = {/Users/loos/Zotero/storage/QDEXZPUE/16.pdf},
Issn = {00092614},
Journal = {Chem. Phys. Lett.},
Language = {en},
Month = jun,
Number = {1-3},
Pages = {120--123},
Title = {Important Effects of Neighbouring Nucleotides on Electron Induced {{DNA}} Single-Strand Breaks},
Volume = {475},
Year = {2009},
Bdsk-Url-1 = {https://dx.doi.org/10.1016/j.cplett.2009.05.041}}
@article{Loos_2009c,
Author = {Loos, Pierre-Fran{\c c}ois and Gill, Peter M. W.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-04-14 07:27:56 +0000},
Doi = {10.1103/PhysRevLett.103.123008},
File = {/Users/loos/Zotero/storage/GRFHDW5F/18.pdf},
Issn = {0031-9007, 1079-7114},
Journal = {Phys. Rev. Lett.},
Language = {en},
Month = sep,
Number = {12},
Pages = {123008},
Shorttitle = {Two {{Electrons}} on a {{Hypersphere}}},
Title = {Two {{Electrons}} on a {{Hypersphere}}: {{A Quasiexactly Solvable Model}}},
Volume = {103},
Year = {2009},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevLett.103.123008}}
@article{Loos_2010,
Author = {Loos, Pierre-Fran{\c c}ois and Gill, Peter M.W.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1016/j.cplett.2010.09.019},
File = {/Users/loos/Zotero/storage/DJKJNV2H/27.pdf},
Issn = {00092614},
Journal = {Chem. Phys. Lett.},
Language = {en},
Month = nov,
Number = {1-3},
Pages = {1--8},
Shorttitle = {A Tale of Two Electrons},
Title = {A Tale of Two Electrons: {{Correlation}} at High Density},
Volume = {500},
Year = {2010},
Bdsk-Url-1 = {https://dx.doi.org/10.1016/j.cplett.2010.09.019}}
@article{Loos_2010a,
Author = {Loos, Pierre-Fran{\c c}ois and Gill, Peter M. W.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1063/1.3455706},
File = {/Users/loos/Zotero/storage/QWSE9HHH/24.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = jun,
Number = {23},
Pages = {234111},
Title = {Correlation Energy of Two Electrons in a Ball},
Volume = {132},
Year = {2010},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.3455706}}
@article{Loos_2010b,
Author = {Loos, Pierre-Fran{\c c}ois and Gill, Peter M. W.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-04-14 07:28:06 +0000},
Doi = {10.1103/PhysRevA.81.052510},
File = {/Users/loos/Zotero/storage/3MZKVWT9/23.pdf},
Issn = {1050-2947, 1094-1622},
Journal = {Phys. Rev. A},
Language = {en},
Month = may,
Number = {5},
Pages = {052510},
Title = {Ground State of Two Electrons on Concentric Spheres},
Volume = {81},
Year = {2010},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevA.81.052510}}
@article{Loos_2010c,
Author = {Loos, Pierre-Fran{\c c}ois},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-04-14 07:28:12 +0000},
Doi = {10.1103/PhysRevA.81.032510},
File = {/Users/loos/Zotero/storage/KJEJ5D77/21.pdf},
Issn = {1050-2947, 1094-1622},
Journal = {Phys. Rev. A},
Language = {en},
Month = mar,
Number = {3},
Pages = {032510},
Title = {Hooke's Law Correlation in Two-Electron Systems},
Volume = {81},
Year = {2010},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevA.81.032510}}
@article{Loos_2010d,
Author = {Loos, Pierre-Fran{\c c}ois and Gill, Peter M. W.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-04-14 07:28:17 +0000},
Doi = {10.1103/PhysRevLett.105.113001},
File = {/Users/loos/Zotero/storage/I2UH4CU5/26.pdf},
Issn = {0031-9007, 1079-7114},
Journal = {Phys. Rev. Lett.},
Language = {en},
Month = sep,
Number = {11},
Pages = {113001},
Title = {Invariance of the {{Correlation Energy}} at {{High Density}} and {{Large Dimension}} in {{Two}}-{{Electron Systems}}},
Volume = {105},
Year = {2010},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevLett.105.113001}}
@article{Loos_2011,
Author = {Loos, Pierre-Fran{\c c}ois and Gill, Peter M. W.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-04-14 07:28:25 +0000},
Doi = {10.1103/PhysRevB.84.033103},
File = {/Users/loos/Zotero/storage/NK4SJ24B/29.pdf},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = jul,
Number = {3},
Pages = {033103},
Title = {Correlation Energy of the Spin-Polarized Uniform Electron Gas at High Density},
Volume = {84},
Year = {2011},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.84.033103}}
@article{Loos_2011a,
Author = {Loos, Pierre-Fran{\c c}ois and Gill, Peter M. W.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-04-14 07:28:30 +0000},
Doi = {10.1103/PhysRevB.83.233102},
File = {/Users/loos/Zotero/storage/2QNIQXM5/28.pdf},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = jun,
Number = {23},
Pages = {233102},
Title = {Exact Energy of the Spin-Polarized Two-Dimensional Electron Gas at High Density},
Volume = {83},
Year = {2011},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.83.233102}}
@article{Loos_2011b,
Author = {Loos, Pierre-Fran{\c c}ois and Gill, Peter M. W.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1063/1.3665393},
File = {/Users/loos/Zotero/storage/R8SHV7JI/31.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = dec,
Number = {21},
Pages = {214111},
Shorttitle = {Thinking Outside the Box},
Title = {Thinking Outside the Box: {{The}} Uniform Electron Gas on a Hypersphere},
Volume = {135},
Year = {2011},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.3665393}}
@article{Loos_2012,
Author = {Loos, Pierre-Fran{\c c}ois and Gill, Peter M. W.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-04-14 07:28:37 +0000},
Doi = {10.1103/PhysRevLett.108.083002},
File = {/Users/loos/Zotero/storage/D5YVLEB5/34.pdf},
Issn = {0031-9007, 1079-7114},
Journal = {Phys. Rev. Lett.},
Language = {en},
Month = feb,
Number = {8},
Pages = {083002},
Title = {Exact {{Wave Functions}} of {{Two}}-{{Electron Quantum Rings}}},
Volume = {108},
Year = {2012},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevLett.108.083002}}
@article{Loos_2012a,
Author = {Loos, Pierre-Fran{\c c}ois and Gill, Peter M.W.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1080/00268976.2012.679634},
File = {/Users/loos/Zotero/storage/H82N8B89/35.pdf},
Issn = {0026-8976, 1362-3028},
Journal = {Mol. Phys.},
Language = {en},
Month = oct,
Number = {19-20},
Pages = {2337--2342},
Title = {Harmonically Trapped Jellium},
Volume = {110},
Year = {2012},
Bdsk-Url-1 = {https://dx.doi.org/10.1080/00268976.2012.679634}}
@article{Loos_2012b,
Author = {Loos, Pierre-Fran{\c c}ois and Gill, Peter M. W.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1002/qua.23155},
File = {/Users/loos/Zotero/storage/PMVR53GF/33.pdf},
Issn = {00207608},
Journal = {Int. J. Quantum Chem.},
Language = {en},
Month = mar,
Number = {6},
Pages = {1712--1716},
Title = {Leading-Order Behavior of the Correlation Energy in the Uniform Electron Gas},
Volume = {112},
Year = {2012},
Bdsk-Url-1 = {https://dx.doi.org/10.1002/qua.23155}}
@article{Loos_2012c,
Author = {Loos, Pierre-Fran{\c c}ois},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1016/j.physleta.2012.05.010},
File = {/Users/loos/Zotero/storage/JUPS4RAD/36.pdf},
Issn = {03759601},
Journal = {Physics Letters A},
Language = {en},
Month = may,
Number = {26-27},
Pages = {1997--2000},
Title = {Understanding Excitons Using Spherical Geometry},
Volume = {376},
Year = {2012},
Bdsk-Url-1 = {https://dx.doi.org/10.1016/j.physleta.2012.05.010}}
@article{Loos_2013,
Author = {Loos, Pierre-Fran{\c c}ois},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1063/1.4790613},
File = {/Users/loos/Zotero/storage/47LGX76U/37.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = feb,
Number = {6},
Pages = {064108},
Title = {High-Density Correlation Energy Expansion of the One-Dimensional Uniform Electron Gas},
Volume = {138},
Year = {2013},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.4790613}}
@article{Loos_2013a,
Author = {Loos, Pierre-Fran{\c c}ois and Gill, Peter M. W.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1063/1.4802589},
File = {/Users/loos/Zotero/storage/5Q2YJGTX/38.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = apr,
Number = {16},
Pages = {164124},
Title = {Uniform Electron Gases. {{I}}. {{Electrons}} on a Ring},
Volume = {138},
Year = {2013},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.4802589}}
@article{Loos_2014,
Author = {Loos, Pierre-Fran{\c c}ois and Gill, Peter M.W.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1016/j.physleta.2013.11.045},
File = {/Users/loos/Zotero/storage/BRNDKC4F/40.pdf},
Issn = {03759601},
Journal = {Physics Letters A},
Language = {en},
Month = jan,
Number = {4},
Pages = {329--333},
Title = {Exact Wave Functions for Concentric Two-Electron Systems},
Volume = {378},
Year = {2014},
Bdsk-Url-1 = {https://dx.doi.org/10.1016/j.physleta.2013.11.045}}
@article{Loos_2014a,
Author = {Loos, Pierre-Fran{\c c}ois},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-04-14 07:28:50 +0000},
Doi = {10.1103/PhysRevA.89.052523},
File = {/Users/loos/Zotero/storage/E8XZBSLG/42.pdf},
Issn = {1050-2947, 1094-1622},
Journal = {Phys. Rev. A},
Language = {en},
Month = may,
Number = {5},
Pages = {052523},
Title = {Generalized Local-Density Approximation and One-Dimensional Finite Uniform Electron Gases},
Volume = {89},
Year = {2014},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevA.89.052523}}
@article{Loos_2014b,
Author = {Loos, Pierre-Fran{\c c}ois and Ball, Caleb J. and Gill, Peter M. W.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1063/1.4867910},
File = {/Users/loos/Zotero/storage/QD667QG2/41.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = may,
Number = {18},
Pages = {18A524},
Title = {Uniform Electron Gases. {{II}}. {{The}} Generalized Local Density Approximation in One Dimension},
Volume = {140},
Year = {2014},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.4867910}}
@article{Loos_2015,
Author = {Loos, Pierre-Fran{\c c}ois and Ball, Caleb J. and Gill, Peter M. W.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1039/C4CP03571B},
File = {/Users/loos/Zotero/storage/4JXMCN8L/44.pdf},
Issn = {1463-9076, 1463-9084},
Journal = {Physical Chemistry Chemical Physics},
Language = {en},
Number = {5},
Pages = {3196--3206},
Title = {Chemistry in One Dimension},
Volume = {17},
Year = {2015},
Bdsk-Url-1 = {https://dx.doi.org/10.1039/C4CP03571B}}
@article{Loos_2015a,
Author = {Loos, Pierre-Fran{\c c}ois and Bloomfield, Nathaniel J. and Gill, Peter M. W.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1063/1.4935374},
File = {/Users/loos/Zotero/storage/HEH82IUH/47.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = nov,
Number = {18},
Pages = {181101},
Shorttitle = {Communication},
Title = {Communication: {{Three}}-Electron Coalescence Points in Two and Three Dimensions},
Volume = {143},
Year = {2015},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.4935374}}
@article{Loos_2015b,
Author = {Loos, Pierre-Fran{\c c}ois and Bressanini, Dario},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1063/1.4922159},
File = {/Users/loos/Zotero/storage/UBTEMR7G/45.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = jun,
Number = {21},
Pages = {214112},
Title = {Nodal Surfaces and Interdimensional Degeneracies},
Volume = {142},
Year = {2015},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.4922159}}
@article{Loos_2016,
Author = {Loos, Pierre-Fran{\c c}ois and Gill, Peter M. W.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1002/wcms.1257},
File = {/Users/loos/Zotero/storage/HEXYAMEN/50.pdf},
Issn = {17590876},
Journal = {Wiley Interdiscip. Rev. Comput. Mol. Sci.},
Language = {en},
Month = jul,
Number = {4},
Pages = {410--429},
Shorttitle = {The Uniform Electron Gas},
Title = {The Uniform Electron Gas: {{The}} Uniform Electron Gas},
Volume = {6},
Year = {2016},
Bdsk-Url-1 = {https://dx.doi.org/10.1002/wcms.1257}}
@article{Loos_2017,
Author = {Loos, Pierre-Fran{\c c}ois and Rivail, Jean-Louis and Assfeld, Xavier},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1007/s00894-017-3347-3},
File = {/Users/loos/Zotero/storage/BFLICA2H/55.pdf},
Issn = {1610-2940, 0948-5023},
Journal = {Journal of Molecular Modeling},
Language = {en},
Month = jun,
Number = {6},
Title = {Iterative Stochastic Subspace Self-Consistent Field Method},
Volume = {23},
Year = {2017},
Bdsk-Url-1 = {https://dx.doi.org/10.1007/s00894-017-3347-3}}
@article{Moreau_2004,
Author = {Moreau, Y. and Loos, P.-F. and Assfeld, X.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1007/s00214-004-0581-4},
File = {/Users/loos/Zotero/storage/I2GBGPYP/1.pdf},
Issn = {1432-881X, 1432-2234},
Journal = {Theor. Chem. Acc.},
Language = {en},
Month = sep,
Number = {4},
Shorttitle = {Solvent Effects on the Asymmetric {{Diels}}?},
Title = {Solvent Effects on the Asymmetric {{Diels}}?{{Alder}} Reaction between Cyclopentadiene and (?)-Menthyl Acrylate Revisited with the Three-Layer Hybrid Local Self-Consistent Field/Molecular Mechanics/Self-Consistent Reaction Field Method},
Volume = {112},
Year = {2004},
Bdsk-Url-1 = {https://dx.doi.org/10.1007/s00214-004-0581-4}}
@article{Preat_2007,
Author = {Preat, Julien and Loos, Pierre-Fran{\c c}ois and Assfeld, Xavier and Jacquemin, Denis and Perp{\`e}te, Eric A.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1016/j.theochem.2006.12.047},
File = {/Users/loos/Zotero/storage/4BZSHB49/7.pdf},
Issn = {01661280},
Journal = {Journal of Molecular Structure: THEOCHEM},
Language = {en},
Month = apr,
Number = {1-3},
Pages = {85--91},
Shorttitle = {A {{TD}}-{{DFT}} Investigation of {{UV}} Spectra of Pyrano{\"\i}dic Dyes},
Title = {A {{TD}}-{{DFT}} Investigation of {{UV}} Spectra of Pyrano{\"\i}dic Dyes: {{A NCM}} vs {{PCM}} Comparison},
Volume = {808},
Year = {2007},
Bdsk-Url-1 = {https://dx.doi.org/10.1016/j.theochem.2006.12.047}}
@article{Preat_2007a,
Author = {Preat, Julien and Loos, Pierre-Fran{\c c}ois and Assfeld, Xavier and Jacquemin, Denis and Perp{\`e}te, Eric A.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1002/qua.21182},
File = {/Users/loos/Zotero/storage/D5F3ED8Z/4.pdf},
Issn = {00207608, 1097461X},
Journal = {Int. J. Quantum Chem.},
Language = {en},
Number = {3},
Pages = {574--585},
Shorttitle = {{{DFT}} and {{TD}}-{{DFT}} Investigation of {{IR}} and {{UV}} Spectra of Solvated Molecules},
Title = {{{DFT}} and {{TD}}-{{DFT}} Investigation of {{IR}} and {{UV}} Spectra of Solvated Molecules: {{Comparison}} of Two {{SCRF}} Continuum Models},
Volume = {107},
Year = {2007},
Bdsk-Url-1 = {https://dx.doi.org/10.1002/qua.21182}}
@inproceedings{Rivail_2006,
Author = {Rivail, J. L. and Bouchy, A. and Loos, P. F.},
Booktitle = {Anales de La {{Asociaci{\'o}n Qu{\'\i}mica Argentina}}},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
File = {/Users/loos/Zotero/storage/XGMNTL9R/3.pdf},
Pages = {19--26},
Publisher = {{SciELO Argentina}},
Title = {Electronic Factors Favouring the Cis Conformation in Proline Peptidic Bonds},
Volume = {94},
Year = {2006}}
@article{Rogers_2016,
Author = {Rogers, Fergus J. M. and Ball, Caleb J. and Loos, Pierre-Fran{\c c}ois},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1103/PhysRevB.93.235114},
File = {/Users/loos/Zotero/storage/PD5I8W55/51.pdf},
Issn = {2469-9950, 2469-9969},
Journal = {Phys. Rev. B},
Language = {en},
Month = jun,
Number = {23},
Title = {Symmetry-Broken Local-Density Approximation for One-Dimensional Systems},
Volume = {93},
Year = {2016},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.93.235114}}
@article{Rogers_2017,
Author = {Rogers, Fergus JM and Loos, Pierre-Fran{\c c}ois},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
File = {/Users/loos/Zotero/storage/EJULV3C4/53.pdf},
Journal = {J. Chem. Phys.},
Number = {4},
Pages = {044114},
Title = {Excited-State {{Wigner}} Crystals},
Volume = {146},
Year = {2017}}
@article{Tognetti_2016,
Author = {Tognetti, Vincent and Loos, Pierre-Fran{\c c}ois},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1063/1.4940919},
File = {/Users/loos/Zotero/storage/B35RYULA/48.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = feb,
Number = {5},
Pages = {054108},
Title = {Natural Occupation Numbers in Two-Electron Quantum Rings},
Volume = {144},
Year = {2016},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.4940919}}
@article{Zhao_2011,
Author = {Zhao, Yan and Loos, Pierre-Fran{\c c}ois and Gill, Peter M. W.},
Date-Added = {2018-02-24 12:51:10 +0000},
Date-Modified = {2018-02-24 12:51:10 +0000},
Doi = {10.1103/PhysRevA.84.032513},
File = {/Users/loos/Zotero/storage/27Q3DAWX/30.pdf},
Issn = {1050-2947, 1094-1622},
Journal = {Phys. Rev. A},
Language = {en},
Month = sep,
Number = {3},
Title = {Correlation Energy of Anisotropic Quantum Dots},
Volume = {84},
Year = {2011},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevA.84.032513}}
@article{Almbladh_1999,
Author = {Almbladh, C.-O. and Barth, U. Von and Leeuwen, R. Van},
File = {/Users/loos/Zotero/storage/7TN6GPFJ/Almbladh_1999.pdf},
Journal = {Int. J. Mod. Phys. B},
Number = {05n06},
Pages = {535--541},
Title = {Variational Total Energies from {{$\Phi$}}-and {{$\Psi$}}-Derivable Theories},
Volume = {13},
Year = {1999}}
@article{Bartlett_1981,
Author = {Bartlett, Rodney J.},
File = {/Users/loos/Zotero/storage/3MKNT5H6/Bartlett_1981.pdf},
Journal = {Annu. Rev. Phys. Chem.},
Number = {1},
Pages = {359--401},
Title = {Many-Body Perturbation Theory and Coupled Cluster Theory for Electron Correlation in Molecules},
Volume = {32},
Year = {1981}}
@article{Berger_2010,
Author = {Berger, J. A. and Reining, Lucia and Sottile, Francesco},
Doi = {10.1103/PhysRevB.82.041103},
File = {/Users/loos/Zotero/storage/6FZPM8KJ/Berger_2010.pdf},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = jul,
Number = {4},
Shorttitle = {{\emph{Ab Initio}} Calculations of Electronic Excitations},
Title = {{\emph{Ab Initio}} Calculations of Electronic Excitations: {{Collapsing}} Spectral Sums},
Volume = {82},
Year = {2010},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.82.041103}}
@article{Berger_2012,
Author = {Berger, J. A. and Reining, Lucia and Sottile, Francesco},
Doi = {10.1103/PhysRevB.85.085126},
File = {/Users/loos/Zotero/storage/LG5MEXAZ/Berger_2012.pdf},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = feb,
Number = {8},
Shorttitle = {Efficient {{G W}} Calculations for {{SnO}} 2 , {{ZnO}}, and Rubrene},
Title = {Efficient {{G W}} Calculations for {{SnO}} 2 , {{ZnO}}, and Rubrene: {{The}} Effective-Energy Technique},
Volume = {85},
Year = {2012},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.85.085126}}
@article{Berger_2014,
Author = {Berger, J A and Romaniello, Pina and Tandetzky, Falk and Mendoza, Bernardo S and Brouder, Christian and Reining, Lucia},
Doi = {10.1088/1367-2630/16/11/119601},
File = {/Users/loos/Zotero/storage/QZKHN82B/Berger_2014.pdf},
Issn = {1367-2630},
Journal = {New J. Phys.},
Month = nov,
Number = {11},
Pages = {119601},
Shorttitle = {Erratum},
Title = {Erratum: {{Solution}} to the Many-Body Problem in One Point ( {{{\emph{New J}}}}{\emph{. }}{{{\emph{Phys}}}}{\emph{.}} {\textbf{16}} 113025)},
Volume = {16},
Year = {2014},
Bdsk-Url-1 = {https://dx.doi.org/10.1088/1367-2630/16/11/119601}}
@article{Blase_2011,
Author = {Blase, X. and Attaccalite, C. and Olevano, V.},
Date-Modified = {2018-04-14 07:20:02 +0000},
Doi = {10.1103/PhysRevB.83.115103},
File = {/Users/loos/Zotero/storage/ATYGAK7I/Blase_2011.pdf},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = mar,
Number = {11},
Pages = {115103},
Title = {First-Principles {{GW}} Calculations for Fullerenes, Porphyrins, Phtalocyanine, and Other Molecules of Interest for Organic Photovoltaic Applications},
Volume = {83},
Year = {2011},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.83.115103}}
@article{Blase_2016,
Author = {Blase, Xavier and Boulanger, Paul and Bruneval, Fabien and Fernandez-Serra, Marivi and Duchemin, Ivan},
Doi = {10.1063/1.4940139},
File = {/Users/loos/Zotero/storage/LWI3LN6F/Blase_2016.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = jan,
Number = {3},
Pages = {034109},
Title = {{{{\emph{GW}}}} and {{Bethe}}-{{Salpeter}} Study of Small Water Clusters},
Volume = {144},
Year = {2016},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.4940139}}
@article{Blase_2018,
Author = {Blase, Xavier and Duchemin, Ivan and Jacquemin, Denis},
Doi = {10.1039/C7CS00049A},
File = {/Users/loos/Zotero/storage/PBGJ3ZVC/Blase_2017.pdf},
Issn = {0306-0012, 1460-4744},
Journal = {Chem. Soc. Rev.},
Language = {en},
Number = {3},
Pages = {1022--1043},
Shorttitle = {The {{Bethe}}\textendash{}{{Salpeter}} Equation in Chemistry},
Title = {The {{Bethe}}\textendash{}{{Salpeter}} Equation in Chemistry: Relations with {{TD}}-{{DFT}}, Applications and Challenges},
Volume = {47},
Year = {2018},
Bdsk-Url-1 = {https://dx.doi.org/10.1039/C7CS00049A}}
@article{Boulanger_2014,
Author = {Boulanger, Paul and Jacquemin, Denis and Duchemin, Ivan and Blase, Xavier},
Doi = {10.1021/ct401101u},
File = {/Users/loos/Zotero/storage/KTW3SS9F/Boulanger_2014.pdf},
Issn = {1549-9618, 1549-9626},
Journal = {J. Chem. Theory Comput.},
Language = {en},
Month = mar,
Number = {3},
Pages = {1212--1218},
Title = {Fast and {{Accurate Electronic Excitations}} in {{Cyanines}} with the {{Many}}-{{Body Bethe}}\textendash{}{{Salpeter Approach}}},
Volume = {10},
Year = {2014},
Bdsk-Url-1 = {https://dx.doi.org/10.1021/ct401101u}}
@article{Bruneval_2009,
Author = {Bruneval, Fabien},
Doi = {10.1103/PhysRevLett.103.176403},
File = {/Users/loos/Zotero/storage/6XJIUUFE/Bruneval_2009.pdf},
Issn = {0031-9007, 1079-7114},
Journal = {Phys. Rev. Lett.},
Language = {en},
Month = oct,
Number = {17},
Title = {G {{W Approximation}} of the {{Many}}-{{Body Problem}} and {{Changes}} in the {{Particle Number}}},
Volume = {103},
Year = {2009},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevLett.103.176403}}
@article{Bruneval_2012,
Author = {Bruneval, Fabien},
Doi = {10.1063/1.4718428},
File = {/Users/loos/Zotero/storage/MVP3WBIS/Bruneval_2012a.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = may,
Number = {19},
Pages = {194107},
Title = {Ionization Energy of Atoms Obtained from {{{\emph{GW}}}} Self-Energy or from Random Phase Approximation Total Energies},
Volume = {136},
Year = {2012},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.4718428}}
@article{Bruneval_2013,
Author = {Bruneval, Fabien and Marques, Miguel A. L.},
Doi = {10.1021/ct300835h},
File = {/Users/loos/Zotero/storage/6ERH93TH/Bruneval_2012b.pdf},
Issn = {1549-9618, 1549-9626},
Journal = {J. Chem. Theory Comput.},
Language = {en},
Month = jan,
Number = {1},
Pages = {324--329},
Title = {Benchmarking the {{Starting Points}} of the {{{\emph{GW}}}} {{Approximation}} for {{Molecules}}},
Volume = {9},
Year = {2013},
Bdsk-Url-1 = {https://dx.doi.org/10.1021/ct300835h}}
@article{Bruneval_2015,
Author = {Bruneval, Fabien and Hamed, Samia M. and Neaton, Jeffrey B.},
Doi = {10.1063/1.4922489},
File = {/Users/loos/Zotero/storage/EVU62PAN/Bruneval_2015.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = jun,
Number = {24},
Pages = {244101},
Title = {A Systematic Benchmark of the {\emph{Ab Initio}} {{Bethe}}-{{Salpeter}} Equation Approach for Low-Lying Optical Excitations of Small Organic Molecules},
Volume = {142},
Year = {2015},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.4922489}}
@article{Bruneval_2016,
Author = {Bruneval, Fabien and Rangel, Tonatiuh and Hamed, Samia M. and Shao, Meiyue and Yang, Chao and Neaton, Jeffrey B.},
Doi = {10.1016/j.cpc.2016.06.019},
File = {/Users/loos/Zotero/storage/CHGLK37T/Bruneval_2016a.pdf},
Issn = {00104655},
Journal = {Comput. Phys. Commun.},
Language = {en},
Month = nov,
Pages = {149--161},
Shorttitle = {Molgw 1},
Title = {Molgw 1: {{Many}}-Body Perturbation Theory Software for Atoms, Molecules, and Clusters},
Volume = {208},
Year = {2016},
Bdsk-Url-1 = {https://dx.doi.org/10.1016/j.cpc.2016.06.019}}
@article{Bruneval_2016a,
Author = {Bruneval, Fabien},
Doi = {10.1063/1.4972003},
File = {/Users/loos/Zotero/storage/2TRSI2LP/Bruneval_2016b.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = dec,
Number = {23},
Pages = {234110},
Title = {Optimized Virtual Orbital Subspace for Faster {{GW}} Calculations in Localized Basis},
Volume = {145},
Year = {2016},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.4972003}}
@article{Caruso_2012,
Author = {Caruso, F. and Rinke, P. and Ren, X. and Scheffler, M. and Rubio, A.},
Date-Modified = {2018-04-14 07:23:04 +0000},
Doi = {10.1103/PhysRevB.86.081102},
File = {/Users/loos/Zotero/storage/2ZGZT4DZ/Caruso_2012.pdf},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = aug,
Number = {8},
Pages = {081102(R)},
Shorttitle = {Unified Description of Ground and Excited States of Finite Systems},
Title = {Unified Description of Ground and Excited States of Finite Systems: {{The}} Self-Consistent {{G W}} Approach},
Volume = {86},
Year = {2012},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.86.081102}}
@article{Caruso_2013a,
Author = {Caruso, Fabio and Rinke, Patrick and Ren, Xinguo and Rubio, Angel and Scheffler, Matthias},
Date-Modified = {2018-04-14 07:22:35 +0000},
Doi = {10.1103/PhysRevB.88.075105},
File = {/Users/loos/Zotero/storage/SACFAD2T/Caruso_2013.pdf},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = aug,
Number = {7},
Pages = {075105},
Shorttitle = {Self-Consistent {{G W}}},
Title = {Self-Consistent {{G W}} : {{All}}-Electron Implementation with Localized Basis Functions},
Volume = {88},
Year = {2013},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.88.075105}}
@article{Caruso_2013,
Author = {Caruso, Fabio and Rohr, Daniel R. and Hellgren, Maria and Ren, Xinguo and Rinke, Patrick and Rubio, Angel and Scheffler, Matthias},
Date-Modified = {2018-04-14 07:22:22 +0000},
Doi = {10.1103/PhysRevLett.110.146403},
File = {/Users/loos/Zotero/storage/UF9F4UWC/Caruso_2013a.pdf;/Users/loos/Zotero/storage/Y3IZUCIX/Caruso_2013b.pdf},
Issn = {0031-9007, 1079-7114},
Journal = {Phys. Rev. Lett.},
Language = {en},
Month = apr,
Number = {14},
Pages = {146403},
Shorttitle = {Bond {{Breaking}} and {{Bond Formation}}},
Title = {Bond {{Breaking}} and {{Bond Formation}}: {{How Electron Correlation}} Is {{Captured}} in {{Many}}-{{Body Perturbation Theory}} and {{Density}}-{{Functional Theory}}},
Volume = {110},
Year = {2013},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevLett.110.146403}}
@phdthesis{Caruso_2013b,
Author = {Caruso, Fabio},
File = {/Users/loos/Zotero/storage/I5Q6ZQCS/Caruso_PhD.pdf},
School = {Freie Universit{\"a}t Berlin},
Title = {Self-Consistent {{GW}} Approach for the Unified Description of Ground and Excited States of Finite Systems},
Type = {{{PhD Thesis}}},
Year = {2013}}
@incollection{Corzo_2017,
Author = {Corzo, H{\'e}ctor H. and Ortiz, J. Vince},
Booktitle = {Advances in Quantum Chemistry},
Date-Modified = {2018-02-24 19:24:27 +0000},
Doi = {10.1016/bs.aiq.2016.05.001},
File = {/Users/loos/Zotero/storage/PT4V59RE/Corzo_2017.pdf},
Isbn = {978-0-12-809988-9},
Language = {en},
Pages = {267--298},
Publisher = {Elsevier},
Title = {Electron Propagator Theory},
Volume = {74},
Year = {2017},
Bdsk-Url-1 = {https://dx.doi.org/10.1016/bs.aiq.2016.05.001}}
@article{Dahlen_2004,
Author = {Dahlen, Nils Erik and von Barth, Ulf},
Date-Modified = {2018-04-14 07:33:15 +0000},
Doi = {10.1103/PhysRevB.69.195102},
File = {/Users/loos/Zotero/storage/JVFRWQV9/Dahlen_2004a.pdf},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = may,
Number = {19},
Pages = {195102},
Title = {Variational Energy Functionals Tested on Atoms},
Volume = {69},
Year = {2004},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.69.195102}}
@article{Dahlen_2004a,
Author = {Dahlen, Nils Erik and {von Barth}, Ulf},
Doi = {10.1063/1.1650307},
File = {/Users/loos/Zotero/storage/6IDAFXL5/Dahlen_2004b.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = apr,
Number = {15},
Pages = {6826--6831},
Title = {Variational Second-Order {{M{\o}ller}}\textendash{}{{Plesset}} Theory Based on the {{Luttinger}}\textendash{}{{Ward}} Functional},
Volume = {120},
Year = {2004},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.1650307}}
@article{Dahlen_2005a,
Author = {Dahlen, Nils Erik and Van Leeuwen, Robert and Von Barth, Ulf},
Doi = {10.1002/qua.20306},
File = {/Users/loos/Zotero/storage/KCXCEUER/Dahlen_2005a.pdf},
Issn = {0020-7608, 1097-461X},
Journal = {Int. J. Quantum Chem.},
Language = {en},
Number = {5},
Pages = {512--519},
Title = {Variational Energy Functionals of the {{Green}} Function Tested on Molecules},
Volume = {101},
Year = {2005},
Bdsk-Url-1 = {https://dx.doi.org/10.1002/qua.20306}}
@article{Dahlen_2005,
Author = {Dahlen, Nils Erik and {van Leeuwen}, Robert},
Doi = {10.1063/1.1884965},
File = {/Users/loos/Zotero/storage/Z984CS8R/Dahlen_2005b.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = apr,
Number = {16},
Pages = {164102},
Title = {Self-Consistent Solution of the {{Dyson}} Equation for Atoms and Molecules within a Conserving Approximation},
Volume = {122},
Year = {2005},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.1884965}}
@article{Dahlen_2006,
Author = {Dahlen, Nils Erik and {van Leeuwen}, Robert and {von Barth}, Ulf},
Date-Modified = {2018-04-14 07:33:30 +0000},
Doi = {10.1103/PhysRevA.73.012511},
File = {/Users/loos/Zotero/storage/CIIYSNSE/Dahlen_2006.pdf},
Issn = {1050-2947, 1094-1622},
Journal = {Phys. Rev. A},
Language = {en},
Month = jan,
Number = {1},
Pages = {012511},
Title = {Variational Energy Functionals of the {{Green}} Function and of the Density Tested on Molecules},
Volume = {73},
Year = {2006},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevA.73.012511}}
@article{Danovich_2011,
Author = {Danovich, David},
Doi = {10.1002/wcms.38},
File = {/Users/loos/Zotero/storage/RQLPMH6E/Danovich_2011.pdf},
Issn = {17590876},
Journal = {Wiley Interdiscip. Rev. Comput. Mol. Sci.},
Language = {en},
Month = may,
Number = {3},
Pages = {377--387},
Shorttitle = {Green's Function Methods for Calculating Ionization Potentials, Electron Affinities, and Excitation Energies},
Title = {Green's Function Methods for Calculating Ionization Potentials, Electron Affinities, and Excitation Energies: {{GF}} Methods for Calculating {{IPs}}, {{EAs}}, and Excitation Energies},
Volume = {1},
Year = {2011},
Bdsk-Url-1 = {https://dx.doi.org/10.1002/wcms.38}}
@article{Dreuw_2005,
Author = {Dreuw, Andreas and Head-Gordon, Martin},
Doi = {10.1021/cr0505627},
File = {/Users/loos/Zotero/storage/WKGXAHGE/Dreuw_2005.pdf},
Issn = {0009-2665, 1520-6890},
Journal = {Chem. Rev.},
Language = {en},
Month = nov,
Number = {11},
Pages = {4009--4037},
Title = {Single-{{Reference}} Ab {{Initio Methods}} for the {{Calculation}} of {{Excited States}} of {{Large Molecules}}},
Volume = {105},
Year = {2005},
Bdsk-Url-1 = {https://dx.doi.org/10.1021/cr0505627}}
@article{Dreuw_2015,
Author = {Dreuw, Andreas and Wormit, Michael},
Doi = {10.1002/wcms.1206},
File = {/Users/loos/Zotero/storage/ZGBF293U/Dreuw_2015.pdf},
Issn = {17590876},
Journal = {Wiley Interdiscip. Rev. Comput. Mol. Sci.},
Language = {en},
Month = jan,
Number = {1},
Pages = {82--95},
Title = {The Algebraic Diagrammatic Construction Scheme for the Polarization Propagator for the Calculation of Excited States},
Volume = {5},
Year = {2015},
Bdsk-Url-1 = {https://dx.doi.org/10.1002/wcms.1206}}
@phdthesis{vanFaassen_2005,
Author = {{van Faassen}, Meta},
File = {/Users/loos/Zotero/storage/PTY6IS9R/Faassen_2015.pdf},
School = {University Library Groningen][Host]},
Title = {Time-Dependent {{Current}}-Density-Functional {{Theory}} for {{Molecules}}},
Type = {{{PhD Thesis}}},
Year = {2005}}
@phdthesis{Faber_2014,
Author = {Faber, Carina},
File = {/Users/loos/Zotero/storage/ZPJDQPGS/Faber_PhD.pdf},
School = {Universit{\'e} de Grenoble},
Shorttitle = {Electronic, Excitonic and Polaronic Properties of Organic Systems within the Many-Body {{GW}} and {{Bethe}}-{{Salpeter}} Formalisms},
Title = {Electronic, Excitonic and Polaronic Properties of Organic Systems within the Many-Body {{GW}} and {{Bethe}}-{{Salpeter}} Formalisms: Towards Organic Photovoltaics},
Type = {{{PhD Thesis}}},
Year = {2014}}
@article{Faleev_2004,
Author = {Faleev, Sergey V. and {van Schilfgaarde}, Mark and Kotani, Takao},
Date-Modified = {2018-04-14 07:31:23 +0000},
Doi = {10.1103/PhysRevLett.93.126406},
File = {/Users/loos/Zotero/storage/YKIDTQ84/Faleev_2004.pdf},
Issn = {0031-9007, 1079-7114},
Journal = {Phys. Rev. Lett.},
Language = {en},
Month = sep,
Number = {12},
Pages = {126406},
Shorttitle = {All-{{Electron Self}}-{{Consistent G W Approximation}}},
Title = {All-{{Electron Self}}-{{Consistent G W Approximation}}: {{Application}} to {{Si}}, {{MnO}}, and {{NiO}}},
Volume = {93},
Year = {2004},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevLett.93.126406}}
@book{March_1999,
Address = {London},
Editor = {March, Norman H.},
File = {/Users/loos/Zotero/storage/7VMQ86HQ/Farid_1999.pdf},
Isbn = {978-1-86094-200-6},
Language = {eng},
Note = {OCLC: 247716792},
Publisher = {{Imperial College Press}},
Title = {Electron Correlation in the Solid State},
Year = {1999}}
@article{Garcia-Gonzalez_2001,
Author = {Garc{\'\i}a-Gonz{\'a}lez, P. and Godby, R. W.},
Date-Modified = {2018-04-14 07:24:41 +0000},
Doi = {10.1103/PhysRevB.63.075112},
File = {/Users/loos/Zotero/storage/4MI62AQA/GarciaGonzales_2001.pdf},
Issn = {0163-1829, 1095-3795},
Journal = {Phys. Rev. B},
Language = {en},
Month = jan,
Number = {7},
Pages = {075112},
Title = {Self-Consistent Calculation of Total Energies of the Electron Gas Using Many-Body Perturbation Theory},
Volume = {63},
Year = {2001},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.63.075112}}
@article{Guzzo_2011,
Author = {Guzzo, Matteo and Lani, Giovanna and Sottile, Francesco and Romaniello, Pina and Gatti, Matteo and Kas, Joshua J. and Rehr, John J. and Silly, Mathieu G. and Sirotti, Fausto and Reining, Lucia},
Doi = {10.1103/PhysRevLett.107.166401},
File = {/Users/loos/Zotero/storage/CML472NW/Guzzo_2011.pdf},
Issn = {0031-9007, 1079-7114},
Journal = {Phys. Rev. Lett.},
Language = {en},
Month = oct,
Number = {16},
Shorttitle = {Valence {{Electron Photoemission Spectrum}} of {{Semiconductors}}},
Title = {Valence {{Electron Photoemission Spectrum}} of {{Semiconductors}}: {{{\emph{Ab Initio}}}} {{Description}} of {{Multiple Satellites}}},
Volume = {107},
Year = {2011},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevLett.107.166401}}
@article{vanSchilfgaarde_2006,
Author = {{van Schilfgaarde}, M. and Kotani, Takao and Faleev, S.},
Date-Modified = {2018-04-14 07:31:33 +0000},
Doi = {10.1103/PhysRevLett.96.226402},
File = {/Users/loos/Zotero/storage/6S8FDHP8/vanSchilfgaarde_2006.pdf},
Issn = {0031-9007, 1079-7114},
Journal = {Phys. Rev. Lett.},
Language = {en},
Month = jun,
Number = {22},
Pages = {226402},
Title = {Quasiparticle {{Self}}-{{Consistent G W Theory}}},
Volume = {96},
Year = {2006},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevLett.96.226402}}
@article{Furche_2008,
Author = {Furche, Filipp},
Doi = {10.1063/1.2977789},
File = {/Users/loos/Zotero/storage/FWTKB6W5/Furche_2008.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = sep,
Number = {11},
Pages = {114105},
Title = {Developing the Random Phase Approximation into a Practical Post-{{Kohn}}\textendash{}{{Sham}} Correlation Model},
Volume = {129},
Year = {2008},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.2977789}}
@article{Hattig_2002,
Author = {H{\"a}ttig, Christof and Hald, Kasper},
Doi = {10.1039/b110847f},
File = {/Users/loos/Zotero/storage/C9SZ4GHZ/Hattig_2002.pdf},
Issn = {14639076, 14639084},
Journal = {Phys. Chem. Chem. Phys.},
Month = may,
Number = {11},
Pages = {2111--2118},
Title = {Implementation of {{RI}}-{{CC2}} Triplet Excitation Energies with an Application to Trans-Azobenzene},
Volume = {4},
Year = {2002},
Bdsk-Url-1 = {https://dx.doi.org/10.1039/b110847f}}
@article{Ismail-Beigi_2010,
Author = {Ismail-Beigi, Sohrab},
Doi = {10.1103/PhysRevB.81.195126},
File = {/Users/loos/Zotero/storage/DAFHBKV5/Ismail-Beigi_2010.pdf},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = may,
Number = {19},
Shorttitle = {Correlation Energy Functional within the {{G W}} -{{RPA}}},
Title = {Correlation Energy Functional within the {{G W}} -{{RPA}}: {{Exact}} Forms, Approximate Forms, and Challenges},
Volume = {81},
Year = {2010},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.81.195126}}
@article{Jacquemin_2017,
Author = {Jacquemin, Denis and Duchemin, Ivan and Blondel, Aymeric and Blase, Xavier},
Doi = {10.1021/acs.jctc.6b01169},
File = {/Users/loos/Zotero/storage/T7RT7DS8/Jacquemin_2017.pdf},
Issn = {1549-9618, 1549-9626},
Journal = {J. Chem. Theory Comput.},
Language = {en},
Month = feb,
Number = {2},
Pages = {767--783},
Title = {Benchmark of {{Bethe}}-{{Salpeter}} for {{Triplet Excited}}-{{States}}},
Volume = {13},
Year = {2017},
Bdsk-Url-1 = {https://dx.doi.org/10.1021/acs.jctc.6b01169}}
@article{LaflammeJanssen_2015,
Author = {Laflamme Janssen, Jonathan and Rousseau, Bruno and C{\^o}t{\'e}, Michel},
Doi = {10.1103/PhysRevB.91.125120},
File = {/Users/loos/Zotero/storage/IT4XRL8J/Janssen_2015.pdf},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = mar,
Number = {12},
Title = {Efficient Dielectric Matrix Calculations Using the {{Lanczos}} Algorithm for Fast Many-Body {{G}} 0 {{W}} 0 Implementations},
Volume = {91},
Year = {2015},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.91.125120}}
@article{Kaplan_2015,
Author = {Kaplan, F. and Weigend, F. and Evers, F. and {van Setten}, M. J.},
Doi = {10.1021/acs.jctc.5b00394},
File = {/Users/loos/Zotero/storage/Y8FW5KVR/Kaplan_2015.pdf},
Issn = {1549-9618, 1549-9626},
Journal = {J. Chem. Theory Comput.},
Language = {en},
Month = nov,
Number = {11},
Pages = {5152--5160},
Shorttitle = {Off-{{Diagonal Self}}-{{Energy Terms}} and {{Partially Self}}-{{Consistency}} in {{{\emph{GW}}}} {{Calculations}} for {{Single Molecules}}},
Title = {Off-{{Diagonal Self}}-{{Energy Terms}} and {{Partially Self}}-{{Consistency}} in {{{\emph{GW}}}} {{Calculations}} for {{Single Molecules}}: {{Efficient Implementation}} and {{Quantitative Effects}} on {{Ionization Potentials}}},
Volume = {11},
Year = {2015},
Bdsk-Url-1 = {https://dx.doi.org/10.1021/acs.jctc.5b00394}}
@article{Kaplan_2016,
Author = {Kaplan, F. and Harding, M. E. and Seiler, C. and Weigend, F. and Evers, F. and {van Setten}, M. J.},
Doi = {10.1021/acs.jctc.5b01238},
File = {/Users/loos/Zotero/storage/MWYM8YMS/Kaplan_2016.pdf},
Issn = {1549-9618, 1549-9626},
Journal = {J. Chem. Theory Comput.},
Language = {en},
Month = jun,
Number = {6},
Pages = {2528--2541},
Title = {Quasi-{{Particle Self}}-{{Consistent}} {{{\emph{GW}}}} for {{Molecules}}},
Volume = {12},
Year = {2016},
Bdsk-Url-1 = {https://dx.doi.org/10.1021/acs.jctc.5b01238}}
@article{Rangel_2017,
Author = {Rangel, Tonatiuh and Hamed, Samia M. and Bruneval, Fabien and Neaton, Jeffrey B.},
Doi = {10.1063/1.4983126},
File = {/Users/loos/Zotero/storage/IPXGTRK7/Rangel_2017.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = may,
Number = {19},
Pages = {194108},
Title = {An Assessment of Low-Lying Excitation Energies and Triplet Instabilities of Organic Molecules with an {\emph{Ab Initio}} {{Bethe}}-{{Salpeter}} Equation Approach and the {{Tamm}}-{{Dancoff}} Approximation},
Volume = {146},
Year = {2017},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.4983126}}
@article{Reining_2017,
Author = {Reining, Lucia},
Doi = {10.1002/wcms.1344},
File = {/Users/loos/Zotero/storage/VDXYCLGF/Reining_2017.pdf},
Issn = {17590876},
Journal = {Wiley Interdiscip. Rev. Comput. Mol. Sci.},
Language = {en},
Month = dec,
Pages = {e1344},
Shorttitle = {The {{GW}} Approximation},
Title = {The {{GW}} Approximation: Content, Successes and Limitations: {{The GW}} Approximation},
Year = {2017},
Bdsk-Url-1 = {https://dx.doi.org/10.1002/wcms.1344}}
@article{Ren_2013,
Author = {Ren, Xinguo and Rinke, Patrick and Scuseria, Gustavo E. and Scheffler, Matthias},
Date-Modified = {2018-04-14 07:32:03 +0000},
Doi = {10.1103/PhysRevB.88.035120},
File = {/Users/loos/Zotero/storage/HMTI4LPK/Ren_2013.pdf},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = jul,
Number = {3},
Pages = {035120},
Shorttitle = {Renormalized Second-Order Perturbation Theory for the Electron Correlation Energy},
Title = {Renormalized Second-Order Perturbation Theory for the Electron Correlation Energy: {{Concept}}, Implementation, and Benchmarks},
Volume = {88},
Year = {2013},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.88.035120}}
@article{Zhang_2017,
Author = {Zhang, Du and Su, Neil Qiang and Yang, Weitao},
Doi = {10.1021/acs.jpclett.7b01275},
File = {/Users/loos/Zotero/storage/ZJ4HTDNE/Zhang_2017.pdf},
Issn = {1948-7185},
Journal = {J. Phys. Chem. Lett.},
Language = {en},
Month = jul,
Number = {14},
Pages = {3223--3227},
Title = {Accurate {{Quasiparticle Spectra}} from the {{T}}-{{Matrix Self}}-{{Energy}} and the {{Particle}}\textendash{}{{Particle Random Phase Approximation}}},
Volume = {8},
Year = {2017},
Bdsk-Url-1 = {https://dx.doi.org/10.1021/acs.jpclett.7b01275}}
@article{Zhukov_2005,
Author = {Zhukov, V. P. and Chulkov, E. V. and Echenique, P. M.},
Doi = {10.1103/PhysRevB.72.155109},
File = {/Users/loos/Zotero/storage/8Q4VYM9Z/Zhukov_2005.pdf},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = oct,
Number = {15},
Title = {{{GW}} + {{T}} Theory of Excited Electron Lifetimes in Metals},
Volume = {72},
Year = {2005},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.72.155109}}
@article{Vlcek_2017,
Author = {Vl{\v c}ek, Vojt{\v e}ch and Rabani, Eran and Neuhauser, Daniel and Baer, Roi},
Doi = {10.1021/acs.jctc.7b00770},
File = {/Users/loos/Zotero/storage/HBVLY4QJ/Vlcek_2017.pdf},
Issn = {1549-9618, 1549-9626},
Journal = {J. Chem. Theory Comput.},
Language = {en},
Month = oct,
Number = {10},
Pages = {4997--5003},
Title = {Stochastic {{GW Calculations}} for {{Molecules}}},
Volume = {13},
Year = {2017},
Bdsk-Url-1 = {https://dx.doi.org/10.1021/acs.jctc.7b00770}}
@article{Sun_2004,
Author = {Sun, Ping and Kotliar, Gabriel},
Doi = {10.1103/PhysRevLett.92.196402},
File = {/Users/loos/Zotero/storage/HQRU6MCS/Sun_2004.pdf},
Issn = {0031-9007, 1079-7114},
Journal = {Phys. Rev. Lett.},
Language = {en},
Month = may,
Number = {19},
Title = {Many-{{Body Approximation Scheme}} beyond {{GW}}},
Volume = {92},
Year = {2004},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevLett.92.196402}}
@article{Yang_2013,
Author = {Yang, Yang and {van Aggelen}, Helen and Steinmann, Stephan N. and Peng, Degao and Yang, Weitao},
Doi = {10.1063/1.4828728},
File = {/Users/loos/Zotero/storage/9LZMQQNK/Yang_2013.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = nov,
Number = {17},
Pages = {174110},
Title = {Benchmark Tests and Spin Adaptation for the Particle-Particle Random Phase Approximation},
Volume = {139},
Year = {2013},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.4828728}}
@article{Willow_2013,
Author = {Willow, Soohaeng Yoo and Kim, Kwang S. and Hirata, So},
Doi = {10.1063/1.4801862},
File = {/Users/loos/Zotero/storage/F8QZMTFD/Willow_2013b.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = apr,
Number = {16},
Pages = {164111},
Title = {Stochastic Evaluation of Second-Order {{Dyson}} Self-Energies},
Volume = {138},
Year = {2013},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.4801862}}
@article{Stan_2009,
Author = {Stan, Adrian and Dahlen, Nils Erik and {van Leeuwen}, Robert},
Doi = {10.1063/1.3089567},
File = {/Users/loos/Zotero/storage/M4YMAWCH/Stan_2009.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = mar,
Number = {11},
Pages = {114105},
Title = {Levels of Self-Consistency in the {{GW}} Approximation},
Volume = {130},
Year = {2009},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.3089567}}
@article{Leng_2016,
Author = {Leng, Xia and Jin, Fan and Wei, Min and Ma, Yuchen},
Doi = {10.1002/wcms.1265},
Issn = {17590876},
Journal = {Wiley Interdiscip. Rev. Comput. Mol. Sci.},
Language = {en},
Month = sep,
Number = {5},
Pages = {532--550},
Shorttitle = {{{GW}} Method and {{Bethe}}-{{Salpeter}} Equation for Calculating Electronic Excitations},
Title = {{{GW}} Method and {{Bethe}}-{{Salpeter}} Equation for Calculating Electronic Excitations: {{GW}} Method and {{Bethe}}-{{Salpeter}} Equation},
Volume = {6},
Year = {2016},
Bdsk-Url-1 = {https://dx.doi.org/10.1002/wcms.1265}}
@article{Kaplan_,
Author = {Kaplan, Ferdinand},
File = {/Users/loos/Zotero/storage/XM6HJ3SR/Kaplan_PhD.pdf},
Shorttitle = {Quasiparticle {{Self}}-{{Consistent GW}}-{{Approximation}} for {{Molecules}}},
Title = {Quasiparticle {{Self}}-{{Consistent GW}}-{{Approximation}} for {{Molecules}}: {{Calculation}} of {{Single}}-{{Particle Excitation Energies}} for {{Molecules}}}}
@article{Ke_2011,
Author = {Ke, San-Huang},
Date-Modified = {2018-04-14 07:26:29 +0000},
Doi = {10.1103/PhysRevB.84.205415},
File = {/Users/loos/Zotero/storage/98P28A6E/Ke_2011.pdf},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = nov,
Number = {20},
Pages = {205415},
Shorttitle = {All-Electron {{G W}} Methods Implemented in Molecular Orbital Space},
Title = {All-Electron {{G W}} Methods Implemented in Molecular Orbital Space: {{Ionization}} Energy and Electron Affinity of Conjugated Molecules},
Volume = {84},
Year = {2011},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.84.205415}}
@article{Knowles_1985,
Author = {Knowles, P. J. and Somasundram, K. and Handy, N. C. and Hirao, K.},
File = {/Users/loos/Zotero/storage/KGTI53ND/Knowles_1985.pdf},
Journal = {Chem. Phys. Lett.},
Number = {1},
Pages = {8--12},
Title = {The Calculation of Higher-Order Energies in the Many-Body Perturbation Theory Series},
Volume = {113},
Year = {1985}}
@article{Knowles_1989,
Author = {Knowles, Peter J. and Handy, Nicholas C.},
File = {/Users/loos/Zotero/storage/XWJJMYAA/Knowles_1989.pdf},
Journal = {Comput. Phys. Commun.},
Number = {1},
Pages = {75--83},
Title = {A Determinant Based Full Configuration Interaction Program},
Volume = {54},
Year = {1989}}
@article{Kotani_2007,
Author = {Kotani, Takao and {van Schilfgaarde}, Mark and Faleev, Sergey V.},
Date-Modified = {2018-04-14 07:31:28 +0000},
Doi = {10.1103/PhysRevB.76.165106},
File = {/Users/loos/Zotero/storage/FIMWDS7X/Kotani_2007.pdf},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = oct,
Number = {16},
Pages = {165106},
Shorttitle = {Quasiparticle Self-Consistent {{G W}} Method},
Title = {Quasiparticle Self-Consistent {{G W}} Method: {{A}} Basis for the Independent-Particle Approximation},
Volume = {76},
Year = {2007},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.76.165106}}
@article{Koval_2014,
Author = {Koval, P. and Foerster, D. and S{\'a}nchez-Portal, D.},
Date-Modified = {2018-04-14 07:24:04 +0000},
Doi = {10.1103/PhysRevB.89.155417},
File = {/Users/loos/Zotero/storage/G3WW5DMD/Koval_2014.pdf},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = apr,
Number = {15},
Pages = {155417},
Title = {Fully Self-Consistent {{G W}} and Quasiparticle Self-Consistent {{G W}} for Molecules},
Volume = {89},
Year = {2014},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.89.155417}}
@article{Krause_2017,
Author = {Krause, Katharina and Klopper, Wim},
Doi = {10.1002/jcc.24688},
File = {/Users/loos/Zotero/storage/4XKBP9ZQ/Krause_2016.pdf},
Issn = {01928651},
Journal = {J. Comput. Chem.},
Language = {en},
Month = mar,
Number = {6},
Pages = {383--388},
Title = {Implementation of the {{Bethe}}-{{Salpeter}} Equation in the {{TURBOMOLE}} Program},
Volume = {38},
Year = {2017},
Bdsk-Url-1 = {https://dx.doi.org/10.1002/jcc.24688}}
@article{Ku_2002,
Author = {Ku, Wei and Eguiluz, Adolfo G.},
Date-Modified = {2018-04-14 07:25:01 +0000},
Doi = {10.1103/PhysRevLett.89.126401},
File = {/Users/loos/Zotero/storage/AATBUYZP/Ku_2002.pdf},
Issn = {0031-9007, 1079-7114},
Journal = {Phys. Rev. Lett.},
Language = {en},
Month = aug,
Number = {12},
Pages = {126401},
Shorttitle = {Band-{{Gap Problem}} in {{Semiconductors Revisited}}},
Title = {Band-{{Gap Problem}} in {{Semiconductors Revisited}}: {{Effects}} of {{Core States}} and {{Many}}-{{Body Self}}-{{Consistency}}},
Volume = {89},
Year = {2002},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevLett.89.126401}}
@article{Kutepov_2016,
Author = {Kutepov, Andrey L.},
Date-Modified = {2018-04-14 07:25:13 +0000},
Doi = {10.1103/PhysRevB.94.155101},
File = {/Users/loos/Zotero/storage/G69H55JQ/Kutepov_2016.pdf},
Issn = {2469-9950, 2469-9969},
Journal = {Phys. Rev. B},
Language = {en},
Month = oct,
Number = {15},
Pages = {155101},
Title = {Electronic Structure of {{Na}}, {{K}}, {{Si}}, and {{LiF}} from Self-Consistent Solution of {{Hedin}}'s Equations Including Vertex Corrections},
Volume = {94},
Year = {2016},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.94.155101}}
@article{Kutepov_2017,
Author = {Kutepov, A. L. and Kotliar, G.},
Date-Modified = {2018-04-14 07:25:34 +0000},
Doi = {10.1103/PhysRevB.96.035108},
File = {/Users/loos/Zotero/storage/LHWCGLTR/Kutepov_2017.pdf},
Issn = {2469-9950, 2469-9969},
Journal = {Phys. Rev. B},
Language = {en},
Month = jul,
Number = {3},
Pages = {035108},
Title = {One-Electron Spectra and Susceptibilities of the Three-Dimensional Electron Gas from Self-Consistent Solutions of {{Hedin}}'s Equations},
Volume = {96},
Year = {2017},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.96.035108}}
@article{Lani_2012,
Author = {Lani, Giovanna and Romaniello, Pina and Reining, Lucia},
Doi = {10.1088/1367-2630/14/1/013056},
File = {/Users/loos/Zotero/storage/RP3LEGVA/Lani_2012.pdf},
Issn = {1367-2630},
Journal = {New J. Phys.},
Month = jan,
Number = {1},
Pages = {013056},
Shorttitle = {Approximations for Many-Body {{Green}}'s Functions},
Title = {Approximations for Many-Body {{Green}}'s Functions: Insights from the Fundamental Equations},
Volume = {14},
Year = {2012},
Bdsk-Url-1 = {https://dx.doi.org/10.1088/1367-2630/14/1/013056}}
@article{Li_2017,
Author = {Li, Jing and Holzmann, Markus and Duchemin, Ivan and Blase, Xavier and Olevano, Valerio},
Date-Modified = {2018-04-14 07:19:11 +0000},
Doi = {10.1103/PhysRevLett.118.163001},
File = {/Users/loos/Zotero/storage/C5UCU783/Li_2017.pdf},
Issn = {0031-9007, 1079-7114},
Journal = {Phys. Rev. Lett.},
Language = {en},
Month = apr,
Number = {16},
Pages = {163001},
Title = {Helium {{Atom Excitations}} by the {{G W}} and {{Bethe}}-{{Salpeter Many}}-{{Body Formalism}}},
Volume = {118},
Year = {2017},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevLett.118.163001}}
@article{Maebashi_2011,
Author = {Maebashi, Hideaki and Takada, Yasutami},
Date-Modified = {2018-04-14 07:29:04 +0000},
Doi = {10.1103/PhysRevB.84.245134},
File = {/Users/loos/Zotero/storage/QXM683TM/Maebashi_2011.pdf},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = dec,
Number = {24},
Pages = {245134},
Title = {Analysis of Exact Vertex Function for Improving on the {{GW $\Gamma$}} Scheme for First-Principles Calculation of Electron Self-Energy},
Volume = {84},
Year = {2011},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.84.245134}}
@article{Mahan_1989,
Author = {Mahan, G. D. and Sernelius, B. E.},
File = {/Users/loos/Zotero/storage/IUL4DA6H/Mahan_1989.pdf},
Journal = {Phys. Rev. Lett.},
Number = {23},
Pages = {2718},
Title = {Electron-Electron Interactions and the Bandwidth of Metals},
Volume = {62},
Year = {1989}}
@article{Head-Gordon_1999,
Author = {Head-Gordon, Martin and Oumi, Manabu and Maurice, David},
Doi = {10.1080/00268979909482996},
File = {/Users/loos/Zotero/storage/TDLEI2LU/Head-Gordon_1999.pdf},
Issn = {0026-8976, 1362-3028},
Journal = {Mol. Phys.},
Language = {en},
Month = feb,
Number = {4},
Pages = {593--602},
Title = {Quasidegenerate Second-Order Perturbation Corrections to Single-Excitation Configuration Interaction},
Volume = {96},
Year = {1999},
Bdsk-Url-1 = {https://dx.doi.org/10.1080/00268979909482996}}
@article{Hedin_1965,
Author = {Hedin, Lars},
Date-Modified = {2018-07-05 09:34:29 +0000},
Doi = {10.1103/PhysRev.139.A796},
File = {/Users/loos/Zotero/storage/ZGMCVKPC/Hedin_1965.pdf},
Journal = {Phys. Rev.},
Number = {3A},
Pages = {A796},
Title = {New Method for Calculating the One-Particle {{Green}}'s Function with Application to the Electron-Gas Problem},
Volume = {139},
Year = {1965},
Bdsk-Url-1 = {https://doi.org/10.1103/PhysRev.139.A796}}
@article{Ohnishi_2016,
Author = {Ohnishi, Yu-ya and Ten-no, Seiichiro},
Doi = {10.1002/jcc.24468},
File = {/Users/loos/Zotero/storage/6QF6TQIF/Ohnishi_2016.pdf},
Issn = {01928651},
Journal = {J. Comput. Chem.},
Language = {en},
Month = oct,
Number = {27},
Pages = {2447--2453},
Shorttitle = {Explicitly Correlated Frequency-Independent Second-Order Green's Function for Accurate Ionization Energies},
Title = {Explicitly Correlated Frequency-Independent Second-Order Green's Function for Accurate Ionization Energies: {{FULL PAPER}}},
Volume = {37},
Year = {2016},
Bdsk-Url-1 = {https://dx.doi.org/10.1002/jcc.24468}}
@article{Hellgren_2015,
Author = {Hellgren, Maria and Caruso, Fabio and Rohr, Daniel R. and Ren, Xinguo and Rubio, Angel and Scheffler, Matthias and Rinke, Patrick},
Date-Modified = {2018-04-14 07:22:53 +0000},
Doi = {10.1103/PhysRevB.91.165110},
File = {/Users/loos/Zotero/storage/CXHEK6Z6/Hellgren_2015.pdf},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = apr,
Number = {16},
Pages = {165110},
Title = {Static Correlation and Electron Localization in Molecular Dimers from the Self-Consistent {{RPA}} and {{G W}} Approximation},
Volume = {91},
Year = {2015},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.91.165110}}
@article{Steinbeck_2000,
Author = {Steinbeck, L. and Rubio, A. and Reining, L. and Torrent, M. and White, I. D. and Godby, R. W.},
File = {/Users/loos/Zotero/storage/4VL6BH4F/Steinbeck_2000.pdf},
Journal = {Comput. Phys. Commun.},
Number = {1-3},
Pages = {105--118},
Title = {Enhancements to the {{GW}} Space-Time Method},
Volume = {125},
Year = {2000}}
@article{Hindgren_1997,
Author = {Hindgren, M. and Almbladh, C.-O.},
File = {/Users/loos/Zotero/storage/V2CSCPQJ/Hindgren_1997.pdf},
Journal = {Phys. Rev. B},
Number = {20},
Pages = {12832},
Shorttitle = {Improved Local-Field Corrections to the {{G}} 0 {{W}} Approximation in Jellium},
Title = {Improved Local-Field Corrections to the {{G}} 0 {{W}} Approximation in Jellium: {{Importance}} of Consistency Relations},
Volume = {56},
Year = {1997}}
@article{Hirata_2015,
Author = {Hirata, So and Hermes, Matthew R. and Simons, Jack and Ortiz, J. V.},
Doi = {10.1021/acs.jctc.5b00005},
File = {/Users/loos/Zotero/storage/FECAFSNP/Hirata_2015.pdf},
Issn = {1549-9618, 1549-9626},
Journal = {J. Chem. Theory Comput.},
Language = {en},
Month = apr,
Number = {4},
Pages = {1595--1606},
Title = {General-{{Order Many}}-{{Body Green}}'s {{Function Method}}},
Volume = {11},
Year = {2015},
Bdsk-Url-1 = {https://dx.doi.org/10.1021/acs.jctc.5b00005}}
@article{Hirata_2017,
Author = {Hirata, So and Doran, Alexander E. and Knowles, Peter J. and Ortiz, J. V.},
Doi = {10.1063/1.4994837},
File = {/Users/loos/Zotero/storage/XYSAJSW4/Hirata_2017.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = jul,
Number = {4},
Pages = {044108},
Shorttitle = {One-Particle Many-Body {{Green}}'s Function Theory},
Title = {One-Particle Many-Body {{Green}}'s Function Theory: {{Algebraic}} Recursive Definitions, Linked-Diagram Theorem, Irreducible-Diagram Theorem, and General-Order Algorithms},
Volume = {147},
Year = {2017},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.4994837}}
@article{Hung_2016,
Author = {Hung, Linda and {da Jornada}, Felipe H. and Souto-Casares, Jaime and Chelikowsky, James R. and Louie, Steven G. and {\"O}{\u g}{\"u}t, Serdar},
Date-Modified = {2018-04-14 07:21:28 +0000},
Doi = {10.1103/PhysRevB.94.085125},
File = {/Users/loos/Zotero/storage/YVJNGCM7/Hung_2016.pdf},
Issn = {2469-9950, 2469-9969},
Journal = {Phys. Rev. B},
Language = {en},
Month = aug,
Number = {8},
Pages = {085125},
Shorttitle = {Excitation Spectra of Aromatic Molecules within a Real-Space {{G W}} -{{BSE}} Formalism},
Title = {Excitation Spectra of Aromatic Molecules within a Real-Space {{G W}} -{{BSE}} Formalism: {{Role}} of Self-Consistency and Vertex Corrections},
Volume = {94},
Year = {2016},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.94.085125}}
@article{Hung_2017,
Author = {Hung, Linda and Bruneval, Fabien and Baishya, Kopinjol and {\"O}{\u g}{\"u}t, Serdar},
Doi = {10.1021/acs.jctc.7b00123},
File = {/Users/loos/Zotero/storage/PHJQ6KXT/Hung_2017.pdf},
Issn = {1549-9618, 1549-9626},
Journal = {J. Chem. Theory Comput.},
Language = {en},
Month = may,
Number = {5},
Pages = {2135--2146},
Title = {Benchmarking the {{{\emph{GW}}}} {{Approximation}} and {{Bethe}}\textendash{}{{Salpeter Equation}} for {{Groups IB}} and {{IIB Atoms}} and {{Monoxides}}},
Volume = {13},
Year = {2017},
Bdsk-Url-1 = {https://dx.doi.org/10.1021/acs.jctc.7b00123}}
@article{Wilhelm_2018,
Author = {Wilhelm, Jan and Golze, Dorothea and Talirz, Leopold and Hutter, J{\"u}rg and Pignedoli, Carlo A.},
Doi = {10.1021/acs.jpclett.7b02740},
File = {/Users/loos/Zotero/storage/3Q9NY2YU/Wilhelm_2018.pdf},
Issn = {1948-7185},
Journal = {J. Phys. Chem. Lett.},
Language = {en},
Month = jan,
Number = {2},
Pages = {306--312},
Title = {Toward {{{\emph{GW}}}} {{Calculations}} on {{Thousands}} of {{Atoms}}},
Volume = {9},
Year = {2018},
Bdsk-Url-1 = {https://dx.doi.org/10.1021/acs.jpclett.7b02740}}
@article{vanSetten_2018,
Author = {{van Setten}, Michiel J. and Costa, Ramon and Vi{\~n}es, Francesc and Illas, Francesc},
Doi = {10.1021/acs.jctc.7b01192},
File = {/Users/loos/Zotero/storage/2KY9G5DS/vanSetten_2018.pdf},
Issn = {1549-9618, 1549-9626},
Journal = {J. Chem. Theory Comput.},
Language = {en},
Month = feb,
Number = {2},
Pages = {877--883},
Title = {Assessing {{{\emph{GW}}}} {{Approaches}} for {{Predicting Core Level Binding Energies}}},
Volume = {14},
Year = {2018},
Bdsk-Url-1 = {https://dx.doi.org/10.1021/acs.jctc.7b01192}}
@article{vanAggelen_2013,
Author = {{van Aggelen}, Helen and Yang, Yang and Yang, Weitao},
Doi = {10.1103/PhysRevA.88.030501},
File = {/Users/loos/Zotero/storage/QWPW6HYS/vanAggelen_2013.pdf},
Issn = {1050-2947, 1094-1622},
Journal = {Phys. Rev. A},
Language = {en},
Month = sep,
Number = {3},
Title = {Exchange-Correlation Energy from Pairing Matrix Fluctuation and the Particle-Particle Random-Phase Approximation},
Volume = {88},
Year = {2013},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevA.88.030501}}
@article{vanAggelen_2014,
Author = {{van Aggelen}, Helen and Yang, Yang and Yang, Weitao},
Doi = {10.1063/1.4865816},
File = {/Users/loos/Zotero/storage/JPZDDCA4/vanAggelen_2014.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = may,
Number = {18},
Pages = {18A511},
Title = {Exchange-Correlation Energy from Pairing Matrix Fluctuation and the Particle-Particle Random Phase Approximation},
Volume = {140},
Year = {2014},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.4865816}}
@article{vanSetten_2013,
Author = {{van Setten}, M. J. and Weigend, F. and Evers, F.},
Doi = {10.1021/ct300648t},
File = {/Users/loos/Zotero/storage/SLTIFNCK/vanSetten_2013.pdf},
Issn = {1549-9618, 1549-9626},
Journal = {J. Chem. Theory Comput.},
Language = {en},
Month = jan,
Number = {1},
Pages = {232--246},
Shorttitle = {The {{{\emph{GW}}}} -{{Method}} for {{Quantum Chemistry Applications}}},
Title = {The {{{\emph{GW}}}} -{{Method}} for {{Quantum Chemistry Applications}}: {{Theory}} and {{Implementation}}},
Volume = {9},
Year = {2013},
Bdsk-Url-1 = {https://dx.doi.org/10.1021/ct300648t}}
@article{Trofimov_2002,
Author = {Trofimov, A. B. and Stelter, G. and Schirmer, J.},
Doi = {10.1063/1.1504708},
File = {/Users/loos/Zotero/storage/BFV2TPGP/Trofimov_2002.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = oct,
Number = {14},
Pages = {6402--6410},
Shorttitle = {Electron Excitation Energies Using a Consistent Third-Order Propagator Approach},
Title = {Electron Excitation Energies Using a Consistent Third-Order Propagator Approach: {{Comparison}} with Full Configuration Interaction and Coupled Cluster Results},
Volume = {117},
Year = {2002},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.1504708}}
@article{Trofimov_2005,
Author = {Trofimov, A. B. and Schirmer, J.},
Doi = {10.1063/1.2047550},
File = {/Users/loos/Zotero/storage/DVPFF5F8/Trofimov_2005.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = oct,
Number = {14},
Pages = {144115},
Title = {Molecular Ionization Energies and Ground- and Ionic-State Properties Using a Non-{{Dyson}} Electron Propagator Approach},
Volume = {123},
Year = {2005},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.2047550}}
@article{Trofimov_2006,
Author = {Trofimov, A.B. and Krivdina, I.L. and Weller, J. and Schirmer, J.},
Doi = {10.1016/j.chemphys.2006.07.015},
File = {/Users/loos/Zotero/storage/IYH37EES/Trofimov_2006.pdf},
Issn = {03010104},
Journal = {Chem. Phys.},
Language = {en},
Month = oct,
Number = {1-3},
Pages = {1--10},
Title = {Algebraic-Diagrammatic Construction Propagator Approach to Molecular Response Properties},
Volume = {329},
Year = {2006},
Bdsk-Url-1 = {https://dx.doi.org/10.1016/j.chemphys.2006.07.015}}
@article{Umari_2009,
Author = {Umari, P. and Stenuit, Geoffrey and Baroni, Stefano},
Doi = {10.1103/PhysRevB.79.201104},
File = {/Users/loos/Zotero/storage/PXE8MFW3/Umari_2009.pdf},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = may,
Number = {20},
Title = {Optimal Representation of the Polarization Propagator for Large-Scale {{G W}} Calculations},
Volume = {79},
Year = {2009},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.79.201104}}
@article{Tiago_2006,
Author = {Tiago, Murilo L. and Chelikowsky, James R.},
Doi = {10.1103/PhysRevB.73.205334},
File = {/Users/loos/Zotero/storage/3YTWEDNW/Tiago_2006.pdf},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = may,
Number = {20},
Title = {Optical Excitations in Organic Molecules, Clusters, and Defects Studied by First-Principles {{Green}}'s Function Methods},
Volume = {73},
Year = {2006},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.73.205334}}
@article{Ou_2016,
Author = {Ou, Qi and Subotnik, Joseph E.},
Doi = {10.1021/acs.jpca.6b03294},
File = {/Users/loos/Zotero/storage/9L34S2JP/Ou_2016.pdf},
Issn = {1089-5639, 1520-5215},
Journal = {J. Phys. Chem. A},
Language = {en},
Month = jul,
Number = {26},
Pages = {4514--4525},
Shorttitle = {Comparison between {{{\emph{GW}}}} and {{Wave}}-{{Function}}-{{Based Approaches}}},
Title = {Comparison between {{{\emph{GW}}}} and {{Wave}}-{{Function}}-{{Based Approaches}}: {{Calculating}} the {{Ionization Potential}} and {{Electron Affinity}} for {{1D Hubbard Chains}}},
Volume = {120},
Year = {2016},
Bdsk-Url-1 = {https://dx.doi.org/10.1021/acs.jpca.6b03294}}
@article{Ou_2018,
Author = {Ou, Qi and Subotnik, Joseph E.},
Doi = {10.1021/acs.jctc.7b00246},
File = {/Users/loos/Zotero/storage/2J2XU5F7/Ou_2017.pdf},
Issn = {1549-9618, 1549-9626},
Journal = {J. Chem. Theory Comput.},
Language = {en},
Month = feb,
Number = {2},
Pages = {527--542},
Shorttitle = {Comparison between the {{Bethe}}\textendash{}{{Salpeter Equation}} and {{Configuration Interaction Approaches}} for {{Solving}} a {{Quantum Chemistry Problem}}},
Title = {Comparison between the {{Bethe}}\textendash{}{{Salpeter Equation}} and {{Configuration Interaction Approaches}} for {{Solving}} a {{Quantum Chemistry Problem}}: {{Calculating}} the {{Excitation Energy}} for {{Finite 1D Hubbard Chains}}},
Volume = {14},
Year = {2018},
Bdsk-Url-1 = {https://dx.doi.org/10.1021/acs.jctc.7b00246}}
@article{Romaniello_2009,
Author = {Romaniello, P. and Guyot, S. and Reining, L.},
Doi = {10.1063/1.3249965},
File = {/Users/loos/Zotero/storage/WCWVRT3M/Romaniello_2009.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = oct,
Number = {15},
Pages = {154111},
Shorttitle = {The Self-Energy beyond {{GW}}},
Title = {The Self-Energy beyond {{GW}}: {{Local}} and Nonlocal Vertex Corrections},
Volume = {131},
Year = {2009},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.3249965}}
@article{Romaniello_2012,
Author = {Romaniello, Pina and Bechstedt, Friedhelm and Reining, Lucia},
Date-Modified = {2018-04-14 07:32:24 +0000},
Doi = {10.1103/PhysRevB.85.155131},
File = {/Users/loos/Zotero/storage/PLHVA772/Romaniello_2012.pdf},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = apr,
Number = {15},
Pages = {155131},
Shorttitle = {Beyond the {{G W}} Approximation},
Title = {Beyond the {{G W}} Approximation: {{Combining}} Correlation Channels},
Volume = {85},
Year = {2012},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.85.155131}}
@article{Tarantino_2017,
Author = {Tarantino, Walter and Romaniello, Pina and Berger, J. A. and Reining, Lucia},
Date-Modified = {2018-04-14 07:27:03 +0000},
Doi = {10.1103/PhysRevB.96.045124},
File = {/Users/loos/Zotero/storage/PE5YGU7F/Romaniello_2017.pdf},
Issn = {2469-9950, 2469-9969},
Journal = {Phys. Rev. B},
Language = {en},
Month = jul,
Number = {4},
Pages = {045124},
Shorttitle = {Self-Consistent {{Dyson}} Equation and Self-Energy Functionals},
Title = {Self-Consistent {{Dyson}} Equation and Self-Energy Functionals: {{An}} Analysis and Illustration on the Example of the {{Hubbard}} Atom},
Volume = {96},
Year = {2017},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.96.045124}}
@article{Rostgaard_2010,
Author = {Rostgaard, C. and Jacobsen, K. W. and Thygesen, K. S.},
Date-Modified = {2018-04-14 07:23:37 +0000},
Doi = {10.1103/PhysRevB.81.085103},
File = {/Users/loos/Zotero/storage/4665L3NK/Rostgaard_2010.pdf},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = feb,
Number = {8},
Pages = {085103},
Title = {Fully Self-Consistent {{GW}} Calculations for Molecules},
Volume = {81},
Year = {2010},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.81.085103}}
@article{Takada_2001,
Author = {Takada, Yasutami},
Doi = {10.1103/PhysRevLett.87.226402},
File = {/Users/loos/Zotero/storage/N3BXLFU9/Takada_2001.pdf},
Issn = {0031-9007, 1079-7114},
Journal = {Phys. Rev. Lett.},
Language = {en},
Month = nov,
Number = {22},
Title = {Inclusion of {{Vertex Corrections}} in the {{Self}}-{{Consistent Calculation}} of {{Quasiparticles}} in {{Metals}}},
Volume = {87},
Year = {2001},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevLett.87.226402}}
@article{Tempere_2002,
Author = {Tempere, J. and Silvera, I. F. and Devreese, J. T.},
Doi = {10.1103/PhysRevB.65.195418},
File = {/Users/loos/Zotero/storage/W8QP2SXG/Tempere_2002.pdf},
Issn = {0163-1829, 1095-3795},
Journal = {Phys. Rev. B},
Language = {en},
Month = may,
Number = {19},
Title = {Many-Body Properties of a Spherical Two-Dimensional Electron Gas},
Volume = {65},
Year = {2002},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.65.195418}}
@article{Tempere_2007,
Author = {Tempere, J and Silvera, I and Devreese, J},
Doi = {10.1016/j.surfrep.2007.03.001},
File = {/Users/loos/Zotero/storage/9EDTRQQ5/Tempere_2007.pdf},
Issn = {01675729},
Journal = {Surf. Sci. Rep.},
Language = {en},
Month = may,
Number = {5},
Pages = {159--217},
Title = {Multielectron Bubbles in Helium as a Paradigm for Studying Electrons on Surfaces with Curvature},
Volume = {62},
Year = {2007},
Bdsk-Url-1 = {https://dx.doi.org/10.1016/j.surfrep.2007.03.001}}
@article{Holm_1998,
Author = {Holm, Bengt and {von Barth}, Ulf},
File = {/Users/loos/Zotero/storage/F8I9X5AH/Holm_1998.pdf},
Journal = {Phys. Rev. B},
Number = {4},
Pages = {2108},
Title = {Fully Self-Consistent {{GW}} Self-Energy of the Electron Gas},
Volume = {57},
Year = {1998}}
@article{Holm_2000,
Author = {Holm, B. and Aryasetiawan, F.},
File = {/Users/loos/Zotero/storage/EX4CWKJL/Holm_2000.pdf},
Journal = {Phys. Rev. B},
Number = {8},
Pages = {4858},
Title = {Total Energy from the {{Galitskii}}-{{Migdal}} Formula Using Realistic Spectral Functions},
Volume = {62},
Year = {2000}}
@article{Schindlmayr_1998,
Author = {Schindlmayr, Arno and Godby, Rex William},
File = {/Users/loos/Zotero/storage/S32MIQEF/Schindlmayr_1998b.pdf},
Journal = {Phys. Rev. Lett.},
Number = {8},
Pages = {1702},
Title = {Systematic Vertex Corrections through Iterative Solution of {{Hedin}}'s Equations beyond the {{GW}} Approximation},
Volume = {80},
Year = {1998}}
@article{Schindlmayr_2013,
Author = {Schindlmayr, Arno},
Date-Modified = {2018-04-14 07:30:17 +0000},
Doi = {10.1103/PhysRevB.87.075104},
File = {/Users/loos/Zotero/storage/I77FWVP2/Schindlmayr_2013.pdf},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = feb,
Number = {7},
Pages = {075104},
Title = {Analytic Evaluation of the Electronic Self-Energy in the {{G W}} Approximation for Two Electrons on a Sphere},
Volume = {87},
Year = {2013},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.87.075104}}
@article{Schirmer_1982,
Author = {Schirmer, Jochen},
File = {/Users/loos/Zotero/storage/YK5MZDWS/Schirmer_1982.pdf},
Journal = {Phys. Rev. A},
Number = {5},
Pages = {2395},
Shorttitle = {Beyond the Random-Phase Approximation},
Title = {Beyond the Random-Phase Approximation: {{A}} New Approximation Scheme for the Polarization Propagator},
Volume = {26},
Year = {1982}}
@article{Schirmer_1983,
Author = {Schirmer, J. and Cederbaum, L. S. and Walter, O.},
File = {/Users/loos/Zotero/storage/4JXGCNBC/Schirmer_1983.pdf},
Journal = {Phys. Rev. A},
Number = {3},
Pages = {1237},
Title = {New Approach to the One-Particle {{Green}}'s Function for Finite {{Fermi}} Systems},
Volume = {28},
Year = {1983}}
@article{Schirmer_2004,
Author = {Schirmer, J. and Trofimov, A. B.},
Doi = {10.1063/1.1752875},
File = {/Users/loos/Zotero/storage/XFMF2EGK/Schirmer_2004.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = jun,
Number = {24},
Pages = {11449--11464},
Title = {Intermediate State Representation Approach to Physical Properties of Electronically Excited Molecules},
Volume = {120},
Year = {2004},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.1752875}}
@article{vanSetten_2015,
Author = {{van Setten}, Michiel J. and Caruso, Fabio and Sharifzadeh, Sahar and Ren, Xinguo and Scheffler, Matthias and Liu, Fang and Lischner, Johannes and Lin, Lin and Deslippe, Jack R. and Louie, Steven G. and Yang, Chao and Weigend, Florian and Neaton, Jeffrey B. and Evers, Ferdinand and Rinke, Patrick},
Doi = {10.1021/acs.jctc.5b00453},
File = {/Users/loos/Zotero/storage/4DNTPV2H/vanSetten_2015.pdf},
Issn = {1549-9618, 1549-9626},
Journal = {J. Chem. Theory Comput.},
Language = {en},
Month = dec,
Number = {12},
Pages = {5665--5687},
Shorttitle = {{{{\emph{GW}}}} 100},
Title = {{{{\emph{GW}}}} 100: {{Benchmarking}} {{{\emph{G}}}} {\textsubscript{0}} {{{\emph{W}}}} {\textsubscript{0}} for {{Molecular Systems}}},
Volume = {11},
Year = {2015},
Bdsk-Url-1 = {https://dx.doi.org/10.1021/acs.jctc.5b00453}}
@article{Holleboom_1990,
Author = {Holleboom, L. J. and Snijders, J. G.},
Doi = {10.1063/1.459578},
File = {/Users/loos/Zotero/storage/N3LJNMRU/Holleboom_1990.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = oct,
Number = {8},
Pages = {5826--5837},
Title = {A Comparison between the {{Mo}}/Ller\textendash{}{{Plesset}} and {{Green}}'s Function Perturbative Approaches to the Calculation of the Correlation Energy in the Many-electron Problem},
Volume = {93},
Year = {1990},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.459578}}
@article{Hybertsen_1985,
Author = {Hybertsen, Mark S. and Louie, Steven G.},
File = {/Users/loos/Zotero/storage/3WVHH8EH/Hybertsen_1985.pdf},
Journal = {Phys. Rev. Lett.},
Number = {13},
Pages = {1418},
Shorttitle = {First-Principles Theory of Quasiparticles},
Title = {First-Principles Theory of Quasiparticles: Calculation of Band Gaps in Semiconductors and Insulators},
Volume = {55},
Year = {1985}}
@article{Stan_2006,
Author = {Stan, A and Dahlen, N. E and van Leeuwen, R.},
Doi = {10.1209/epl/i2006-10266-6},
File = {/Users/loos/Zotero/storage/A2TAP2VH/Stan_2006.pdf},
Issn = {0295-5075, 1286-4854},
Journal = {Europhys. Lett. EPL},
Month = oct,
Number = {2},
Pages = {298--304},
Title = {Fully Self-Consistent {{{\emph{GW}}}} Calculations for Atoms and Molecules},
Volume = {76},
Year = {2006},
Bdsk-Url-1 = {https://dx.doi.org/10.1209/epl/i2006-10266-6}}
@article{Shishkin_2007,
Author = {Shishkin, M. and Kresse, G.},
Date-Modified = {2018-04-14 07:31:12 +0000},
Doi = {10.1103/PhysRevB.75.235102},
File = {/Users/loos/Zotero/storage/24DHAPLN/Shishkin_2007.pdf},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = jun,
Number = {23},
Pages = {235102},
Title = {Self-Consistent {{G W}} Calculations for Semiconductors and Insulators},
Volume = {75},
Year = {2007},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.75.235102}}
@article{Ren_2015,
Author = {Ren, Xinguo and Marom, Noa and Caruso, Fabio and Scheffler, Matthias and Rinke, Patrick},
Date-Modified = {2018-04-14 07:32:07 +0000},
Doi = {10.1103/PhysRevB.92.081104},
File = {/Users/loos/Zotero/storage/DK4SKK42/Ren_2015.pdf},
Issn = {1098-0121, 1550-235X},
Journal = {Phys. Rev. B},
Language = {en},
Month = aug,
Number = {8},
Pages = {081104},
Shorttitle = {Beyond the {{G W}} Approximation},
Title = {Beyond the {{G W}} Approximation: {{A}} Second-Order Screened Exchange Correction},
Volume = {92},
Year = {2015},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevB.92.081104}}
@article{Neuhauser_2014,
Author = {Neuhauser, Daniel and Gao, Yi and Arntsen, Christopher and Karshenas, Cyrus and Rabani, Eran and Baer, Roi},
Doi = {10.1103/PhysRevLett.113.076402},
File = {/Users/loos/Zotero/storage/BQNS7ZC3/Neuhauser_2014.pdf},
Issn = {0031-9007, 1079-7114},
Journal = {Phys. Rev. Lett.},
Language = {en},
Month = aug,
Number = {7},
Shorttitle = {Breaking the {{Theoretical Scaling Limit}} for {{Predicting Quasiparticle Energies}}},
Title = {Breaking the {{Theoretical Scaling Limit}} for {{Predicting Quasiparticle Energies}}: {{The Stochastic G W Approach}}},
Volume = {113},
Year = {2014},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevLett.113.076402}}
@article{Neuhauser_2017,
Author = {Neuhauser, Daniel and Baer, Roi and Zgid, Dominika},
Doi = {10.1021/acs.jctc.7b00792},
File = {/Users/loos/Zotero/storage/JAB74MSA/Neuhauser_2017.pdf},
Issn = {1549-9618, 1549-9626},
Journal = {J. Chem. Theory Comput.},
Language = {en},
Month = nov,
Number = {11},
Pages = {5396--5403},
Title = {Stochastic {{Self}}-{{Consistent Second}}-{{Order Green}}'s {{Function Method}} for {{Correlation Energies}} of {{Large Electronic Systems}}},
Volume = {13},
Year = {2017},
Bdsk-Url-1 = {https://dx.doi.org/10.1021/acs.jctc.7b00792}}
@article{Ortiz_2013,
Author = {Ortiz, Joseph Vincent},
Doi = {10.1002/wcms.1116},
File = {/Users/loos/Zotero/storage/46YWTF9F/Ortiz_2013.pdf},
Issn = {17590876},
Journal = {Wiley Interdiscip. Rev. Comput. Mol. Sci.},
Language = {en},
Month = mar,
Number = {2},
Pages = {123--142},
Shorttitle = {Electron Propagator Theory},
Title = {Electron Propagator Theory: An Approach to Prediction and Interpretation in Quantum Chemistry: {{Electron}} Propagator Theory},
Volume = {3},
Year = {2013},
Bdsk-Url-1 = {https://dx.doi.org/10.1002/wcms.1116}}
@article{Pavlyukh_2016,
Author = {Pavlyukh, Y. and Uimonen, A.-M. and Stefanucci, G. and {van Leeuwen}, R.},
Doi = {10.1103/PhysRevLett.117.206402},
File = {/Users/loos/Zotero/storage/CB7B27J4/Pavlyukh_2006.pdf},
Issn = {0031-9007, 1079-7114},
Journal = {Phys. Rev. Lett.},
Language = {en},
Month = nov,
Number = {20},
Title = {Vertex {{Corrections}} for {{Positive}}-{{Definite Spectral Functions}} of {{Simple Metals}}},
Volume = {117},
Year = {2016},
Bdsk-Url-1 = {https://dx.doi.org/10.1103/PhysRevLett.117.206402}}
@article{Pavosevic_2017,
Author = {Pavo{\v s}evi{\'c}, Fabijan and Peng, Chong and Ortiz, J. V. and Valeev, Edward F.},
Doi = {10.1063/1.5000916},
File = {/Users/loos/Zotero/storage/CPREHP25/Pavosevic_2017.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = sep,
Number = {12},
Pages = {121101},
Shorttitle = {Communication},
Title = {Communication: {{Explicitly}} Correlated Formalism for Second-Order Single-Particle {{Green}}'s Function},
Volume = {147},
Year = {2017},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.5000916}}
@article{Peng_2013,
Author = {Peng, Degao and Steinmann, Stephan N. and {van Aggelen}, Helen and Yang, Weitao},
Doi = {10.1063/1.4820556},
File = {/Users/loos/Zotero/storage/2PKBAZ2I/Peng_2013.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = sep,
Number = {10},
Pages = {104112},
Title = {Equivalence of Particle-Particle Random Phase Approximation Correlation Energy and Ladder-Coupled-Cluster Doubles},
Volume = {139},
Year = {2013},
Bdsk-Url-1 = {https://dx.doi.org/10.1063/1.4820556}}
@article{Stan_2015,
Author = {Adrian Stan and Pina Romaniello and Santiago Rigamonti and Lucia Reining and J A Berger},
Date-Modified = {2018-07-05 09:39:07 +0000},
Doi = {10.1088/1367-2630/17/9/093045},
Journal = {New J. Phys.},
Number = {9},
Pages = {093045},
Title = {Unphysical and physical solutions in many-body theories: from weak to strong correlation},
Volume = {17},
Year = {2015},
Bdsk-Url-1 = {https://doi.org/10.1088/1367-2630/17/9/093045}}
@article{Tarantino_2018,
Author = {Walter Tarantino and Bernardo S Mendoza and Pina Romaniello and J A Berger and Lucia Reining},
Journal = {J. Phys.: Condensed Matter},
Number = {13},
Pages = {135602},
Title = {Many-body perturbation theory and non-perturbative approaches: screened interaction as the key ingredient},
Volume = {30},
Year = {2018}}
@article{Romaniello_2009_JCP,
Author = {Romaniello,P. and Sangalli,D. and Berger,J. A. and Sottile,F. and Molinari,L. G. and Reining,L. and Onida,G.},
Doi = {10.1063/1.3065669},
Journal = {J. Chem. Phys.},
Number = {4},
Pages = {044108},
Title = {Double excitations in finite systems},
Volume = {130},
Year = {2009},
Bdsk-Url-1 = {https://doi.org/10.1063/1.3065669}}
@article{Kozik_2014,
Author = {Kozik, Evgeny and Ferrero, Michel and Georges, Antoine},
Doi = {10.1103/PhysRevLett.114.156402},
Issue = {15},
Journal = {Phys. Rev. Lett.},
Month = {Apr},
Numpages = {5},
Pages = {156402},
Publisher = {American Physical Society},
Title = {Nonexistence of the Luttinger-Ward Functional and Misleading Convergence of Skeleton Diagrammatic Series for Hubbard-Like Models},
Volume = {114},
Year = {2015},
Bdsk-Url-1 = {https://doi.org/10.1103/PhysRevLett.114.156402}}
@article{Schaefer_2013,
Author = {Sch\"afer, T. and Rohringer, G. and Gunnarsson, O. and Ciuchi, S. and Sangiovanni, G. and Toschi, A.},
Doi = {10.1103/PhysRevLett.110.246405},
Issue = {24},
Journal = {Phys. Rev. Lett.},
Month = {Jun},
Numpages = {5},
Pages = {246405},
Publisher = {American Physical Society},
Title = {Divergent Precursors of the Mott-Hubbard Transition at the Two-Particle Level},
Volume = {110},
Year = {2013},
Bdsk-Url-1 = {https://doi.org/10.1103/PhysRevLett.110.246405}}
@article{Schaefer_2016,
Author = {Sch\"afer, T. and Ciuchi, S. and Wallerberger, M. and Thunstr\"om, P. and Gunnarsson, O. and Sangiovanni, G. and Rohringer, G. and Toschi, A.},
Doi = {10.1103/PhysRevB.94.235108},
Issue = {23},
Journal = {Phys. Rev. B},
Month = {Dec},
Numpages = {25},
Pages = {235108},
Publisher = {American Physical Society},
Title = {Nonperturbative landscape of the Mott-Hubbard transition: Multiple divergence lines around the critical endpoint},
Url = {https://link.aps.org/doi/10.1103/PhysRevB.94.235108},
Volume = {94},
Year = {2016},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevB.94.235108},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevB.94.235108}}
@article{Rossi_2015,
Abstract = {Recently, Kozik, Ferrero and Georges discovered numerically that for a family of fundamental models of interacting fermions, the self-energy ##IMG## [http://ej.iop.org/images/1751-8121/48/48/485202/jpaaa05f8ieqn1.gif] {${\rm{\Sigma }}[G]$} is a multi-valued functional of the fully dressed single-particle propagator G , and that the skeleton diagrammatic series ##IMG## [http://ej.iop.org/images/1751-8121/48/48/485202/jpaaa05f8ieqn2.gif] {${{\rm{\Sigma }}}_{{\rm{bold}}}[G]$} converges to the wrong branch above a critical interaction strength. We consider the zero space-time dimensional case, where the same mathematical phenomena appear from elementary algebra. We also find a similar phenomenology for the fully bold formalism built on the fully dressed single-particle propagator and pair propagator.},
Author = {Riccardo Rossi and F{\'e}lix Werner},
Date-Modified = {2018-07-18 13:15:08 +0000},
Journal = {J. Phys. A: Math. Theor.},
Number = {48},
Pages = {485202},
Title = {Skeleton series and multivaluedness of the self-energy functional in zero space-time dimensions},
Url = {http://stacks.iop.org/1751-8121/48/i=48/a=485202},
Volume = {48},
Year = {2015},
Bdsk-Url-1 = {http://stacks.iop.org/1751-8121/48/i=48/a=485202}}
@article{Gunnarsson_2017,
Author = {Gunnarsson, O. and Rohringer, G. and Sch\"afer, T. and Sangiovanni, G. and Toschi, A.},
Doi = {10.1103/PhysRevLett.119.056402},
Issue = {5},
Journal = {Phys. Rev. Lett.},
Month = {Aug},
Numpages = {5},
Pages = {056402},
Publisher = {American Physical Society},
Title = {Breakdown of Traditional Many-Body Theories for Correlated Electrons},
Url = {https://link.aps.org/doi/10.1103/PhysRevLett.119.056402},
Volume = {119},
Year = {2017},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevLett.119.056402},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevLett.119.056402}}
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