loos/BSE_JPCLperspective
1
0
Fork 0
Code Issues Pull Requests Releases Wiki Activity
e6a1f7f2f6
BSE_JPCLperspective/Manuscript/xbbib.bib

1715 lines
64 KiB
BibTeX
Raw Blame History

This file contains ambiguous Unicode characters

This file contains Unicode characters that might be confused with other characters. If you think that this is intentional, you can safely ignore this warning. Use the Escape button to reveal them.

%% This BibTeX bibliography file was created using BibDesk.
%% http://bibdesk.sourceforge.net/
%% Created for Pierre-Francois Loos at 2020-05-13 11:30:11 +0200
%% Saved with string encoding Unicode (UTF-8)
@inbook{Casida_1995,
Author = {M. E. Casida},
Date-Added = {2020-05-13 10:10:00 +0200},
Date-Modified = {2020-05-13 10:10:00 +0200},
Doi = {10.1142/9789812830586_0005},
Editor = {D. P. Chong},
Pages = {155--192},
Publisher = {World Scientific, Singapore},
Series = {Recent Advances in Density Functional Methods},
Title = {Time-Dependent Density Functional Response Theory for Molecules},
Year = {1995},
Bdsk-Url-1 = {https://doi.org/10.1142/9789812830586_0005}}
@article{Casida_1998,
Author = {Casida, Mark E. and Jamorski, Christine and Casida, Kim C. and Salahub, Dennis R.},
Date-Added = {2020-05-13 10:10:00 +0200},
Date-Modified = {2020-05-13 10:10:00 +0200},
Doi = {10.1063/1.475855},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = mar,
Number = {11},
Pages = {4439-4449},
Shorttitle = {Molecular Excitation Energies to High-Lying Bound States from Time-Dependent Density-Functional Response Theory},
Title = {Molecular Excitation Energies to High-Lying Bound States from Time-Dependent Density-Functional Response Theory: {{Characterization}} and Correction of the Time-Dependent Local Density Approximation Ionization Threshold},
Volume = {108},
Year = {1998},
Bdsk-Url-1 = {https://doi.org/10.1063/1.475855}}
@article{Casida_2000,
Author = {Casida, Mark E. and Salahub, Dennis R.},
Date-Added = {2020-05-13 10:10:00 +0200},
Date-Modified = {2020-05-13 10:10:00 +0200},
Doi = {10.1063/1.1319649},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = nov,
Number = {20},
Pages = {8918-8935},
Shorttitle = {Asymptotic Correction Approach to Improving Approximate Exchange\textendash{}Correlation Potentials},
Title = {Asymptotic Correction Approach to Improving Approximate Exchange\textendash{}Correlation Potentials: {{Time}}-Dependent Density-Functional Theory Calculations of Molecular Excitation Spectra},
Volume = {113},
Year = {2000},
Bdsk-Url-1 = {https://doi.org/10.1063/1.1319649}}
@article{Casida_2012,
Author = {Casida, M.E. and Huix-Rotllant, M.},
Date-Added = {2020-05-13 10:10:00 +0200},
Date-Modified = {2020-05-13 10:10:00 +0200},
Journal = {Annu. Rev. Phys. Chem.},
Pages = {287},
Title = {Progress in Time-Dependent Density-Functional Theory},
Volume = {63},
Year = {2012}}
@article{Huix-Rotllant_2010,
Author = {{Huix-Rotllant}, Miquel and Natarajan, Bhaarathi and Ipatov, Andrei and Muhavini Wawire, C. and Deutsch, Thierry and Casida, Mark E.},
Date-Added = {2020-05-13 10:10:00 +0200},
Date-Modified = {2020-05-13 10:10:00 +0200},
Doi = {10.1039/c0cp00273a},
Issn = {1463-9076, 1463-9084},
Journal = {Phys. Chem. Chem. Phys.},
Language = {en},
Number = {39},
Pages = {12811},
Title = {Assessment of Noncollinear Spin-Flip {{Tamm}}\textendash{{Dancoff}} Approximation Time-Dependent Density-Functional Theory for the Photochemical Ring-Opening of Oxirane},
Volume = {12},
Year = {2010},
Bdsk-Url-1 = {https://doi.org/10.1039/c0cp00273a}}
@article{Huix-Rotllant_2011,
Author = {{Huix-Rotllant}, Miquel and Ipatov, Andrei and Rubio, Angel and Casida, Mark E.},
Date-Added = {2020-05-13 10:10:00 +0200},
Date-Modified = {2020-05-13 10:10:00 +0200},
Doi = {10.1016/j.chemphys.2011.03.019},
File = {/Users/loos/Zotero/storage/A4JUV4M4/Huix-Rotllant et al. - 2011 - Assessment of dressed time-dependent density-funct.pdf},
Issn = {03010104},
Journal = {Chem. Phys.},
Language = {en},
Month = nov,
Number = {1},
Pages = {120-129},
Title = {Assessment of Dressed Time-Dependent Density-Functional Theory for the Low-Lying Valence States of 28 Organic Chromophores},
Volume = {391},
Year = {2011},
Bdsk-Url-1 = {https://doi.org/10.1016/j.chemphys.2011.03.019}}
@article{Runge_1984,
Author = {Runge, E. and Gross, E. K. U.},
Date-Added = {2020-05-13 10:09:39 +0200},
Date-Modified = {2020-05-13 10:09:39 +0200},
Doi = {10.1103/PhysRevLett.52.997},
Journal = PRL,
Pages = {997--1000},
Title = {Density-Functional Theory for Time-Dependent Systems},
Volume = 52,
Year = 1984,
Bdsk-Url-1 = {https://doi.org/10.1103/PhysRevLett.52.997}}
@article{Dreuw_2005,
Author = {Dreuw, Andreas and Head-Gordon, Martin},
Date-Added = {2020-05-13 10:09:21 +0200},
Date-Modified = {2020-05-13 10:09:21 +0200},
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}}
@misc{Nobel_2003,
Author = {{{The Royal Swedish Academy of Sciences}}},
Date-Added = {2020-05-13 10:00:08 +0200},
Date-Modified = {2020-05-13 10:02:28 +0200},
Howpublished = {Press release},
Month = {Oct},
Title = {The Nobel Prize in Chemistry 2013},
Year = {2013}}
@article{Gatti_2007,
Author = {M. Gatti and V. Olevano and L. Reining,and I. V. Tokatly},
Date-Added = {2020-04-17 10:10:16 +0200},
Date-Modified = {2020-04-17 10:11:34 +0200},
Doi = {10.1103/PhysRevLett.99.057401},
Journal = {Phys. Rev. Lett.},
Pages = {057401},
Title = {Transforming Nonlocality into a Frequency Dependence: A Shortcut to Spectroscopy},
Volume = {99},
Year = {2007},
Bdsk-Url-1 = {https://doi.org/10.1103/PhysRevLett.99.057401}}
@article{Sangalli_2011,
Author = {Sangalli, Davide and Romaniello, Pina and Onida, Giovanni and Marini, Andrea},
Date-Added = {2020-04-17 10:04:29 +0200},
Date-Modified = {2020-04-17 10:04:29 +0200},
Doi = {10.1063/1.3518705},
File = {/Users/loos/Zotero/storage/9S3XW2FJ/Sangalli et al. - 2011 - Double excitations in correlated systems A many--b.pdf},
Issn = {0021-9606, 1089-7690},
Journal = {J. Chem. Phys.},
Language = {en},
Month = jan,
Number = {3},
Pages = {034115},
Shorttitle = {Double Excitations in Correlated Systems},
Title = {Double Excitations in Correlated Systems: {{A}} Many\textendash{}Body Approach},
Volume = {134},
Year = {2011},
Bdsk-Url-1 = {https://doi.org/10.1063/1.3518705}}
@article{Dreuw_2015,
Author = {Dreuw, Andreas and Wormit, Michael},
Date-Added = {2020-04-16 22:30:10 +0200},
Date-Modified = {2020-04-16 22:30:10 +0200},
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}}
@article{Reining_2017,
Author = {Reining, Lucia},
Date-Added = {2020-04-16 22:29:34 +0200},
Date-Modified = {2020-04-16 22:29:34 +0200},
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{Aryasetiawan_1998,
Author = {F. Aryasetiawan and O. Gunnarsson},
Date-Added = {2020-04-16 22:29:07 +0200},
Date-Modified = {2020-04-16 22:29:07 +0200},
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{vanderHorst_1999,
Author = {van der Horst, J.-W. and Bobbert, P. A. and Michels, M. A. J. and Brocks, G. and Kelly, P. J.},
Date-Added = {2020-04-16 22:26:21 +0200},
Date-Modified = {2020-04-16 22:26:21 +0200},
Doi = {10.1103/PhysRevLett.83.4413},
Issue = {21},
Journal = {Phys. Rev. Lett.},
Month = {Nov},
Numpages = {0},
Pages = {4413--4416},
Publisher = {American Physical Society},
Title = {Ab Initio Calculation of the Electronic and Optical Excitations in Polythiophene: Effects of Intra- and Interchain Screening},
Url = {https://link.aps.org/doi/10.1103/PhysRevLett.83.4413},
Volume = {83},
Year = {1999},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevLett.83.4413},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevLett.83.4413}}
@article{Albrecht_1998,
Author = {Albrecht, Stefan and Reining, Lucia and Del Sole, Rodolfo and Onida, Giovanni},
Date-Added = {2020-04-16 22:25:42 +0200},
Date-Modified = {2020-04-16 22:25:42 +0200},
Doi = {10.1103/PhysRevLett.80.4510},
Issue = {20},
Journal = {Phys. Rev. Lett.},
Month = {May},
Numpages = {0},
Pages = {4510--4513},
Publisher = {American Physical Society},
Title = {Ab Initio Calculation of Excitonic Effects in the Optical Spectra of Semiconductors},
Url = {https://link.aps.org/doi/10.1103/PhysRevLett.80.4510},
Volume = {80},
Year = {1998},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevLett.80.4510},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevLett.80.4510}}
@article{Strinati_1982,
Author = {G. Strinati},
Date-Added = {2020-04-16 22:25:20 +0200},
Date-Modified = {2020-04-16 22:25:20 +0200},
Doi = {10.1103/PhysRevLett.49.1519},
Journal = {Phys. Rev. Lett.},
Pages = {1519},
Title = {Dynamical Shift and Broadening of Core Excitons in Semiconductors},
Volume = {49},
Year = {1982},
Bdsk-Url-1 = {https://doi.org/10.1103/PhysRevLett.49.1519}}
@article{Strinati_1984,
Author = {G. Strinati},
Date-Added = {2020-04-16 22:25:20 +0200},
Date-Modified = {2020-04-16 22:25:20 +0200},
Doi = {10.1103/PhysRevB.29.5718},
Journal = {Phys. Rev. B},
Pages = {5718},
Title = {Effects of Dynamical Screening on Resonances at Inner-Shell Thresholds in Semiconductors},
Volume = {29},
Year = {1984},
Bdsk-Url-1 = {https://doi.org/10.1103/PhysRevB.29.5718}}
@article{Strinati_1988,
Author = {Strinati, G.},
Date-Added = {2020-04-16 22:25:20 +0200},
Date-Modified = {2020-04-16 22:25:20 +0200},
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{Jacquemin_2015a,
Author = {Jacquemin, Denis and Duchemin, Ivan and Blase, Xavier},
Date-Added = {2020-04-16 20:53:30 +0200},
Date-Modified = {2020-04-16 20:53:32 +0200},
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{Hedin_1965,
Author = {Hedin, Lars},
Doi = {10.1103/PhysRev.139.A796},
Issue = {3A},
Journal = {Phys. Rev.},
Month = {Aug},
Numpages = {0},
Pages = {A796--A823},
Publisher = {American Physical Society},
Title = {New Method for Calculating the One-Particle Green's Function with Application to the Electron-Gas Problem},
Url = {http://link.aps.org/doi/10.1103/PhysRev.139.A796},
Volume = {139},
Year = {1965},
Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRev.139.A796},
Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRev.139.A796}}
@book{Farid_1999,
Author = {Behnam Farid},
Editor = {N.H. March},
Publisher = {Imperial College Press, London},
Title = {Electron Correlation in the Solid State - Chapter 3},
Year = {1999}}
@article{Strinati_1980,
Author = {Strinati, G. and Mattausch, H. J. and Hanke, W.},
Doi = {10.1103/PhysRevLett.45.290},
Issue = {4},
Journal = {Phys. Rev. Lett.},
Month = {Jul},
Numpages = {0},
Pages = {290--294},
Publisher = {American Physical Society},
Title = {Dynamical Correlation Effects on the Quasiparticle Bloch States of a Covalent Crystal},
Url = {http://link.aps.org/doi/10.1103/PhysRevLett.45.290},
Volume = {45},
Year = {1980},
Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevLett.45.290},
Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevLett.45.290}}
@article{Perdew_1983,
Author = {Perdew, John P. and Levy, Mel},
Doi = {10.1103/PhysRevLett.51.1884},
Issue = {20},
Journal = {Phys. Rev. Lett.},
Month = {Nov},
Numpages = {0},
Pages = {1884--1887},
Publisher = {American Physical Society},
Title = {Physical Content of the Exact Kohn-Sham Orbital Energies: Band Gaps and Derivative Discontinuities},
Url = {https://link.aps.org/doi/10.1103/PhysRevLett.51.1884},
Volume = {51},
Year = {1983},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevLett.51.1884},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevLett.51.1884}}
@article{Sham_1983,
Author = {Sham, L. J. and Schl\"uter, M.},
Doi = {10.1103/PhysRevLett.51.1888},
Issue = {20},
Journal = {Phys. Rev. Lett.},
Month = {Nov},
Numpages = {0},
Pages = {1888--1891},
Publisher = {American Physical Society},
Title = {Density-Functional Theory of the Energy Gap},
Url = {https://link.aps.org/doi/10.1103/PhysRevLett.51.1888},
Volume = {51},
Year = {1983},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevLett.51.1888},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevLett.51.1888}}
@article{Hybertsen_1986,
Author = {Hybertsen, Mark S. and Louie, Steven G.},
Doi = {10.1103/PhysRevB.34.5390},
Issue = {8},
Journal = {Phys. Rev. B},
Month = {Oct},
Numpages = {0},
Pages = {5390--5413},
Publisher = {American Physical Society},
Title = {Electron Correlation in Semiconductors and Insulators: Band Gaps and Quasiparticle Energies},
Url = {http://link.aps.org/doi/10.1103/PhysRevB.34.5390},
Volume = {34},
Year = {1986},
Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevB.34.5390},
Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevB.34.5390}}
@article{Godby_1988,
Author = {Godby, R. W. and Schl\"uter, M. and Sham, L. J.},
Doi = {10.1103/PhysRevB.37.10159},
Issue = {17},
Journal = {Phys. Rev. B},
Month = {Jun},
Numpages = {0},
Pages = {10159--10175},
Publisher = {American Physical Society},
Title = {Self-Energy Operators and Exchange-Correlation Potentials in Semiconductors},
Url = {http://link.aps.org/doi/10.1103/PhysRevB.37.10159},
Volume = {37},
Year = {1988},
Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevB.37.10159},
Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevB.37.10159}}
@article{Linden_1988,
Author = {von der Linden, Wolfgang and Horsch, Peter},
Doi = {10.1103/PhysRevB.37.8351},
Issue = {14},
Journal = {Phys. Rev. B},
Month = {May},
Numpages = {0},
Pages = {8351--8362},
Publisher = {American Physical Society},
Title = {Precise Quasiparticle Energies and Hartree-Fock Bands of Semiconductors and Insulators},
Url = {https://link.aps.org/doi/10.1103/PhysRevB.37.8351},
Volume = {37},
Year = {1988},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevB.37.8351},
Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevB.37.8351}}
@article{Ary98,
Author = {F Aryasetiawan and O Gunnarsson},
Doi = {10.1088/0034-4885/61/3/002},
Journal = {Rep. Prog. Phys.},
Month = {mar},
Number = {3},
Pages = {237--312},
Publisher = {{IOP} Publishing},
Title = {{The GW method}},
Url = {https://doi.org/10.1088%2F0034-4885%2F61%2F3%2F002},
Volume = {61},
Year = 1998,
Bdsk-Url-1 = {https://doi.org/10.1088%2F0034-4885%2F61%2F3%2F002},
Bdsk-Url-2 = {https://doi.org/10.1088/0034-4885/61/3/002}}
@article{Northrup_1991,
Author = {Northrup, John E. and Hybertsen, Mark S. and Louie, Steven G.},
Doi = {10.1103/PhysRevLett.66.500},
Issue = {4},
Journal = {Phys. Rev. Lett.},
Month = {Jan},
Numpages = {0},
Pages = {500--503},
Publisher = {American Physical Society},
Title = {Many-body Calculation of the Surface-State Energies for Si(111)2\ifmmode\times\else\texttimes\fi{}1},
Url = {https://link.aps.org/doi/10.1103/PhysRevLett.66.500},
Volume = {66},
Year = {1991},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevLett.66.500},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevLett.66.500}}
@article{Blase_1994,
Author = {Blase, X. and Zhu, Xuejun and Louie, Steven G.},
Doi = {10.1103/PhysRevB.49.4973},
Issue = {7},
Journal = {Phys. Rev. B},
Month = {Feb},
Numpages = {0},
Pages = {4973--4980},
Publisher = {American Physical Society},
Title = {Self-Energy Effects on the Surface-State Energies of H-Si(111)1\ifmmode\times\else\texttimes\fi{}1},
Url = {https://link.aps.org/doi/10.1103/PhysRevB.49.4973},
Volume = {49},
Year = {1994},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevB.49.4973},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevB.49.4973}}
@article{Blase_1995,
Author = {Blase, X. and Rubio, Angel and Louie, Steven G. and Cohen, Marvin L.},
Doi = {10.1103/PhysRevB.51.6868},
Issue = {11},
Journal = {Phys. Rev. B},
Month = {Mar},
Numpages = {0},
Pages = {6868--6875},
Publisher = {American Physical Society},
Title = {Quasiparticle Band Structure of Bulk Hexagonal Boron Nitride and Related Systems},
Url = {https://link.aps.org/doi/10.1103/PhysRevB.51.6868},
Volume = {51},
Year = {1995},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevB.51.6868},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevB.51.6868}}
@article{Rohlfing_1995,
Author = {Rohlfing, Michael and Kr{\"u}ger, Peter and Pollmann, Johannes},
Doi = {10.1103/PhysRevB.52.1905},
Issue = {3},
Journal = {Phys. Rev. B},
Month = {Jul},
Numpages = {0},
Pages = {1905--1917},
Publisher = {American Physical Society},
Title = {Efficient Scheme for GW Quasiparticle Band-Structure Calculations with Aapplications to Bulk Si and to the Si(001)-(2\ifmmode\times\else\texttimes\fi{}1) Surface},
Url = {https://link.aps.org/doi/10.1103/PhysRevB.52.1905},
Volume = {52},
Year = {1995},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevB.52.1905},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevB.52.1905}}
@article{Verdozzi_1995,
Author = {Verdozzi, C. and Godby, R. W. and Holloway, S.},
Doi = {10.1103/PhysRevLett.74.2327},
Issue = {12},
Journal = {Phys. Rev. Lett.},
Month = {Mar},
Numpages = {0},
Pages = {2327--2330},
Publisher = {American Physical Society},
Title = {Evaluation of $\mathit{GW}$ Approximations for the Self-Energy of a Hubbard Cluster},
Url = {https://link.aps.org/doi/10.1103/PhysRevLett.74.2327},
Volume = {74},
Year = {1995},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevLett.74.2327},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevLett.74.2327}}
@article{Campillo_1999,
Author = {Campillo, I. and Pitarke, J. M. and Rubio, A. and Zarate, E. and Echenique, P. M.},
Doi = {10.1103/PhysRevLett.83.2230},
Issue = {11},
Journal = {Phys. Rev. Lett.},
Month = {Sep},
Numpages = {0},
Pages = {2230--2233},
Publisher = {American Physical Society},
Title = {Inelastic Lifetimes of Hot Electrons in Real Metals},
Url = {https://link.aps.org/doi/10.1103/PhysRevLett.83.2230},
Volume = {83},
Year = {1999},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevLett.83.2230},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevLett.83.2230}}
@article{Onida_2002,
Author = {Onida, Giovanni and Reining, Lucia and Rubio, Angel},
Date-Modified = {2020-04-16 22:28:27 +0200},
Doi = {10.1103/RevModPhys.74.601},
Issue = {2},
Journal = {Rev. Mod. Phys.},
Month = {Jun},
Numpages = {0},
Pages = {601--659},
Publisher = {American Physical Society},
Title = {Electronic excitations: density-functional versus many-body Green's-function approaches},
Url = {https://link.aps.org/doi/10.1103/RevModPhys.74.601},
Volume = {74},
Year = {2002},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/RevModPhys.74.601},
Bdsk-Url-2 = {https://doi.org/10.1103/RevModPhys.74.601}}
@book{ReiningBook,
Author = {Martin, R.M. and Reining, L. and Ceperley, D.M.},
Isbn = {0521871506},
Publisher = {Cambridge University Press},
Title = {Interacting Electrons: Theory and Computational Approaches},
Year = {2016}}
@article{Golze_2019rev,
Author = {Golze, Dorothea and Dvorak, Marc and Rinke, Patrick},
Doi = {10.3389/fchem.2019.00377},
Issn = {2296-2646},
Journal = {Front. Chem.},
Pages = {377},
Title = {The GW Compendium: A Practical Guide to Theoretical Photoemission Spectroscopy},
Url = {https://www.frontiersin.org/article/10.3389/fchem.2019.00377},
Volume = {7},
Year = {2019},
Bdsk-Url-1 = {https://www.frontiersin.org/article/10.3389/fchem.2019.00377},
Bdsk-Url-2 = {https://doi.org/10.3389/fchem.2019.00377}}
@article{Salpeter_1951,
Author = {Salpeter, E. E. and Bethe, H. A.},
Doi = {10.1103/PhysRev.84.1232},
Issue = {6},
Journal = {Phys. Rev.},
Month = {Dec},
Numpages = {0},
Pages = {1232--1242},
Publisher = {American Physical Society},
Title = {A Relativistic Equation for Bound-State Problems},
Url = {https://link.aps.org/doi/10.1103/PhysRev.84.1232},
Volume = {84},
Year = {1951},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRev.84.1232},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRev.84.1232}}
@article{Sham_1966,
Author = {Sham, L. J. and Rice, T. M.},
Doi = {10.1103/PhysRev.144.708},
Issue = {2},
Journal = {Phys. Rev.},
Month = {Apr},
Numpages = {0},
Pages = {708--714},
Publisher = {American Physical Society},
Title = {Many-Particle Derivation of the Effective-Mass Equation for the Wannier Exciton},
Url = {https://link.aps.org/doi/10.1103/PhysRev.144.708},
Volume = {144},
Year = {1966},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRev.144.708},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRev.144.708}}
@article{Onida_1995,
Author = {Onida, Giovanni and Reining, Lucia and Godby, R. W. and Del Sole, R. and Andreoni, Wanda},
Doi = {10.1103/PhysRevLett.75.818},
Issue = {5},
Journal = {Phys. Rev. Lett.},
Month = {Jul},
Numpages = {0},
Pages = {818--821},
Publisher = {American Physical Society},
Title = {Ab Initio Calculations of the Quasiparticle and Absorption Spectra of Clusters: The Sodium Tetramer},
Url = {https://link.aps.org/doi/10.1103/PhysRevLett.75.818},
Volume = {75},
Year = {1995},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevLett.75.818},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevLett.75.818}}
@article{Albrecht_1997,
Author = {Albrecht, Stefan and Onida, Giovanni and Reining, Lucia},
Date-Modified = {2020-04-16 22:26:08 +0200},
Doi = {10.1103/PhysRevB.55.10278},
Issue = {16},
Journal = {Phys. Rev. B},
Month = {Apr},
Numpages = {0},
Pages = {10278--10281},
Publisher = {American Physical Society},
Title = {Ab initio Calculation of the Quasiparticle Spectrum and Excitonic Effects in ${\mathrm{Li}}_{2}$O},
Url = {https://link.aps.org/doi/10.1103/PhysRevB.55.10278},
Volume = {55},
Year = {1997},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevB.55.10278},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevB.55.10278}}
@article{Rohlfing_1998,
Author = {Rohlfing, Michael and Louie, Steven G.},
Doi = {10.1103/PhysRevLett.80.3320},
Issue = {15},
Journal = {Phys. Rev. Lett.},
Month = {Apr},
Numpages = {0},
Pages = {3320--3323},
Publisher = {American Physical Society},
Title = {Excitonic Effects and the Optical Absorption Spectrum of Hydrogenated Si Clusters},
Url = {https://link.aps.org/doi/10.1103/PhysRevLett.80.3320},
Volume = {80},
Year = {1998},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevLett.80.3320},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevLett.80.3320}}
@article{Benedict_1998,
Author = {Benedict, Lorin X. and Shirley, Eric L. and Bohn, Robert B.},
Doi = {10.1103/PhysRevLett.80.4514},
Issue = {20},
Journal = {Phys. Rev. Lett.},
Month = {May},
Numpages = {0},
Pages = {4514--4517},
Publisher = {American Physical Society},
Title = {Optical Absorption of Insulators and the Electron-Hole Interaction: An Ab Initio Calculation},
Url = {https://link.aps.org/doi/10.1103/PhysRevLett.80.4514},
Volume = {80},
Year = {1998},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevLett.80.4514},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevLett.80.4514}}
@article{Rohlfing_1999,
Author = {Rohlfing, Michael and Louie, Steven G.},
Doi = {10.1103/PhysRevLett.83.856},
Issue = {4},
Journal = {Phys. Rev. Lett.},
Month = {Jul},
Numpages = {0},
Pages = {856--859},
Publisher = {American Physical Society},
Title = {Excitons and Optical Spectrum of the $\mathrm{Si}(111)\ensuremath{-}(2\ifmmode\times\else\texttimes\fi{}1)$ Surface},
Url = {https://link.aps.org/doi/10.1103/PhysRevLett.83.856},
Volume = {83},
Year = {1999},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevLett.83.856},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevLett.83.856}}
@article{Rohlfing_2000,
Author = {Rohlfing, Michael and Louie, Steven G.},
Doi = {10.1103/PhysRevB.62.4927},
Issue = {8},
Journal = {Phys. Rev. B},
Month = {Aug},
Numpages = {0},
Pages = {4927--4944},
Publisher = {American Physical Society},
Title = {Electron-hole excitations and optical spectra from first principles},
Url = {https://link.aps.org/doi/10.1103/PhysRevB.62.4927},
Volume = {62},
Year = {2000},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevB.62.4927},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevB.62.4927}}
@article{Delerue_2000,
Author = {Delerue, C. and Lannoo, M. and Allan, G.},
Doi = {10.1103/PhysRevLett.84.2457},
Issue = {11},
Journal = {Phys. Rev. Lett.},
Month = {Mar},
Numpages = {0},
Pages = {2457--2460},
Publisher = {American Physical Society},
Title = {Excitonic and Quasiparticle Gaps in Si Nanocrystals},
Url = {https://link.aps.org/doi/10.1103/PhysRevLett.84.2457},
Volume = {84},
Year = {2000},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevLett.84.2457},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevLett.84.2457}}
@article{Ren_2012,
Author = {Xinguo Ren and Patrick Rinke and Volker Blum and J{\"u}rgen Wieferink and Alexandre Tkatchenko and Andrea Sanfilippo and Karsten Reuter and Matthias Scheffler},
Doi = {10.1088/1367-2630/14/5/053020},
Journal = {New J. Phys.},
Month = {may},
Number = {5},
Pages = {053020},
Publisher = {{IOP} Publishing},
Title = {Resolution-of-identity approach to Hartree{\textendash}Fock, hybrid density functionals, {RPA}, {MP}2 {andGWwith} numeric atom-centered orbital basis functions},
Url = {https://doi.org/10.1088%2F1367-2630%2F14%2F5%2F053020},
Volume = {14},
Year = 2012,
Bdsk-Url-1 = {https://doi.org/10.1088%2F1367-2630%2F14%2F5%2F053020},
Bdsk-Url-2 = {https://doi.org/10.1088/1367-2630/14/5/053020}}
@article{Ping_2013,
Abstract = {We describe state of the art methods for the calculation of electronic excitations in solids and molecules{,} based on many body perturbation theory{,} and we discuss some applications of these methods to the study of band edges and absorption processes in representative materials used as photoelectrodes for water splitting.},
Author = {Ping, Yuan and Rocca, Dario and Galli, Giulia},
Doi = {10.1039/C3CS00007A},
Issue = {6},
Journal = {Chem. Soc. Rev.},
Pages = {2437-2469},
Publisher = {The Royal Society of Chemistry},
Title = {Electronic excitations in light absorbers for photoelectrochemical energy conversion: first principles calculations based on many body perturbation theory},
Url = {http://dx.doi.org/10.1039/C3CS00007A},
Volume = {42},
Year = {2013},
Bdsk-Url-1 = {http://dx.doi.org/10.1039/C3CS00007A}}
@article{Leng_2016,
Author = {Leng, Xia and Jin, Fan and Wei, Min and Ma, Yuchen},
Doi = {10.1002/wcms.1265},
Eprint = {https://onlinelibrary.wiley.com/doi/pdf/10.1002/wcms.1265},
Journal = {WIREs Computational Molecular Science},
Number = {5},
Pages = {532-550},
Title = {GW method and Bethe--Salpeter equation for calculating electronic excitations},
Url = {https://onlinelibrary.wiley.com/doi/abs/10.1002/wcms.1265},
Volume = {6},
Year = {2016},
Bdsk-Url-1 = {https://onlinelibrary.wiley.com/doi/abs/10.1002/wcms.1265},
Bdsk-Url-2 = {https://doi.org/10.1002/wcms.1265}}
@article{Blase_2018,
Author = {Blase, Xavier and Duchemin, Ivan and Jacquemin, Denis},
Doi = {10.1039/C7CS00049A},
Issue = {3},
Journal = {Chem. Soc. Rev.},
Pages = {1022-1043},
Publisher = {The Royal Society of Chemistry},
Title = {The Bethe--Salpeter equation in chemistry: relations with TD-DFT{,} applications and challenges},
Url = {http://dx.doi.org/10.1039/C7CS00049A},
Volume = {47},
Year = {2018},
Bdsk-Url-1 = {http://dx.doi.org/10.1039/C7CS00049A}}
@article{Bruneval_2015,
Author = {Bruneval,Fabien and Hamed,Samia M. and Neaton,Jeffrey B.},
Doi = {10.1063/1.4922489},
Eprint = {https://doi.org/10.1063/1.4922489},
Journal = {J. Chem. Phys.},
Number = {24},
Pages = {244101},
Title = {A systematic benchmark of the ab initio Bethe-Salpeter equation approach for low-lying optical excitations of small organic molecules},
Url = {https://doi.org/10.1063/1.4922489},
Volume = {142},
Year = {2015},
Bdsk-Url-1 = {https://doi.org/10.1063/1.4922489}}
@article{Jacquemin_2015b,
Author = {Jacquemin, Denis and Duchemin, Ivan and Blase, Xavier},
Doi = {10.1021/acs.jctc.5b00619},
Eprint = {https://doi.org/10.1021/acs.jctc.5b00619},
Journal = {J. Chem. Theory Comput.},
Note = {PMID: 26574326},
Number = {11},
Pages = {5340-5359},
Title = {0--0 Energies Using Hybrid Schemes: Benchmarks of TD-DFT, CIS(D), ADC(2), CC2, and BSE/GW formalisms for 80 Real-Life Compounds},
Url = {https://doi.org/10.1021/acs.jctc.5b00619},
Volume = {11},
Year = {2015},
Bdsk-Url-1 = {https://doi.org/10.1021/acs.jctc.5b00619}}
@article{Hirose_2015,
Author = {Hirose, Daichi and Noguchi, Yoshifumi and Sugino, Osamu},
Doi = {10.1103/PhysRevB.91.205111},
Issue = {20},
Journal = {Phys. Rev. B},
Month = {May},
Numpages = {8},
Pages = {205111},
Publisher = {American Physical Society},
Title = {All-electron $GW$+Bethe-Salpeter calculations on small molecules},
Url = {https://link.aps.org/doi/10.1103/PhysRevB.91.205111},
Volume = {91},
Year = {2015},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevB.91.205111},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevB.91.205111}}
@article{Jacquemin_2017,
Author = {Jacquemin, Denis and Duchemin, Ivan and Blase, Xavier},
Doi = {10.1021/acs.jpclett.7b00381},
Eprint = {https://doi.org/10.1021/acs.jpclett.7b00381},
Journal = {J. Phys. Chem. Lett.},
Note = {PMID: 28301726},
Number = {7},
Pages = {1524-1529},
Title = {Is the Bethe--Salpeter Formalism Accurate for Excitation Energies? Comparisons with TD-DFT, CASPT2, and EOM-CCSD},
Url = {https://doi.org/10.1021/acs.jpclett.7b00381},
Volume = {8},
Year = {2017},
Bdsk-Url-1 = {https://doi.org/10.1021/acs.jpclett.7b00381}}
@article{Azarias_2017,
Author = {Azarias, Clo{\'e} and Habert, Chlo\'{e} and Budz\'{a}k, \check{S}imon and Blase, Xavier and Duchemin, Ivan and Jacquemin, Denis},
Doi = {10.1021/acs.jpca.7b05222},
Eprint = {https://doi.org/10.1021/acs.jpca.7b05222},
Journal = {J. Phys. Chem. A},
Note = {PMID: 28738157},
Number = {32},
Pages = {6122-6134},
Title = {Calculations of n→π* Transition Energies: Comparisons Between TD-DFT, ADC, CC, CASPT2, and BSE/GW Descriptions},
Url = {https://doi.org/10.1021/acs.jpca.7b05222},
Volume = {121},
Year = {2017},
Bdsk-Url-1 = {https://doi.org/10.1021/acs.jpca.7b05222}}
@article{Krause_2017,
Abstract = {A software update solving the Bethe−Salpeter equation ...},
Author = {Krause, Katharina and Klopper, Wim},
Date-Modified = {2020-04-16 20:52:23 +0200},
Doi = {10.1002/jcc.24688},
Eprint = {https://onlinelibrary.wiley.com/doi/pdf/10.1002/jcc.24688},
Journal = {J. Comp. Chem.},
Keywords = {electronic excitation energy, time-dependent density-functional theory, Bethe−Salpeter equation, resolution-of-the-identity approximation, exchange interaction},
Number = {6},
Pages = {383-388},
Title = {Implementation of the Bethe-Salpeter equation in the TURBOMOLE program},
Url = {https://onlinelibrary.wiley.com/doi/abs/10.1002/jcc.24688},
Volume = {38},
Year = {2017},
Bdsk-Url-1 = {https://onlinelibrary.wiley.com/doi/abs/10.1002/jcc.24688},
Bdsk-Url-2 = {https://doi.org/10.1002/jcc.24688}}
@article{Gui_2018,
Author = {Gui, Xin and Holzer, Christof and Klopper, Wim},
Doi = {10.1021/acs.jctc.8b00014},
Eprint = {https://doi.org/10.1021/acs.jctc.8b00014},
Journal = {J. Chem. Theory Comput.},
Note = {PMID: 29499116},
Number = {4},
Pages = {2127-2136},
Title = {Accuracy Assessment of GW Starting Points for Calculating Molecular Excitation Energies Using the Bethe--Salpeter Formalism},
Url = {https://doi.org/10.1021/acs.jctc.8b00014},
Volume = {14},
Year = {2018},
Bdsk-Url-1 = {https://doi.org/10.1021/acs.jctc.8b00014}}
@article{Dreuw_2004,
Author = {Dreuw, Andreas and Head-Gordon, Martin},
Date-Modified = {2020-04-17 20:05:23 +0200},
Doi = {10.1021/ja039556n},
Eprint = {https://doi.org/10.1021/ja039556n},
Journal = {Journal of the American Chemical Society},
Note = {PMID: 15038755},
Number = {12},
Pages = {4007-4016},
Title = {Failure of Time-Dependent Density Functional Theory for Long-Range Charge-Transfer Excited States: The Zincbacteriochlorin-Bacteriochlorin and Bacteriochlorophyll-Spheroidene Complexes},
Url = {https://doi.org/10.1021/ja039556n},
Volume = {126},
Year = {2004},
Bdsk-Url-1 = {https://doi.org/10.1021/ja039556n}}
@article{Blase_2011,
Author = {Blase,X. and Attaccalite,C.},
Doi = {10.1063/1.3655352},
Eprint = {https://doi.org/10.1063/1.3655352},
Journal = {Applied Physics Letters},
Number = {17},
Pages = {171909},
Title = {Charge-transfer excitations in molecular donor-acceptor complexes within the many-body Bethe-Salpeter approach},
Url = {https://doi.org/10.1063/1.3655352},
Volume = {99},
Year = {2011},
Bdsk-Url-1 = {https://doi.org/10.1063/1.3655352}}
@article{Duchemin_2012,
Author = {Duchemin, I. and Deutsch, T. and Blase, X.},
Doi = {10.1103/PhysRevLett.109.167801},
Issue = {16},
Journal = {Phys. Rev. Lett.},
Month = {Oct},
Numpages = {6},
Pages = {167801},
Publisher = {American Physical Society},
Title = {Short-Range to Long-Range Charge-Transfer Excitations in the Zincbacteriochlorin-Bacteriochlorin Complex: A Bethe-Salpeter Study},
Url = {https://link.aps.org/doi/10.1103/PhysRevLett.109.167801},
Volume = {109},
Year = {2012},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevLett.109.167801},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevLett.109.167801}}
@article{Baumeier_2012,
Author = {Baumeier, Bj{\"o}rn and Andrienko, Denis and Rohlfing, Michael},
Doi = {10.1021/ct300311x},
Eprint = {https://doi.org/10.1021/ct300311x},
Journal = {Journal of Chemical Theory and Computation},
Note = {PMID: 26592120},
Number = {8},
Pages = {2790-2795},
Title = {Frenkel and Charge-Transfer Excitations in Donor--acceptor Complexes from Many-Body Green's Functions Theory},
Url = {https://doi.org/10.1021/ct300311x},
Volume = {8},
Year = {2012},
Bdsk-Url-1 = {https://doi.org/10.1021/ct300311x}}
@article{Ziaei_2016,
Author = {Ziaei,Vafa and Bredow,Thomas},
Doi = {10.1063/1.4966920},
Eprint = {https://doi.org/10.1063/1.4966920},
Journal = {The Journal of Chemical Physics},
Number = {17},
Pages = {174305},
Title = {GW-BSE approach on S1 vertical transition energy of large charge transfer compounds: A performance assessment},
Url = {https://doi.org/10.1063/1.4966920},
Volume = {145},
Year = {2016},
Bdsk-Url-1 = {https://doi.org/10.1063/1.4966920}}
@article{Hirose_2017,
Author = {Hirose,Daichi and Noguchi,Yoshifumi and Sugino,Osamu},
Doi = {10.1063/1.4974320},
Eprint = {https://doi.org/10.1063/1.4974320},
Journal = {J. Chem. Phys.},
Number = {4},
Pages = {044303},
Title = {Quantitative characterization of exciton from GW + Bethe-Salpeter calculation},
Url = {https://doi.org/10.1063/1.4974320},
Volume = {146},
Year = {2017},
Bdsk-Url-1 = {https://doi.org/10.1063/1.4974320}}
@article{Hummer_2004,
Author = {Hummer, Kerstin and Puschnig, Peter and Ambrosch-Draxl, Claudia},
Doi = {10.1103/PhysRevLett.92.147402},
Issue = {14},
Journal = {Phys. Rev. Lett.},
Month = {Apr},
Numpages = {4},
Pages = {147402},
Publisher = {American Physical Society},
Title = {Lowest Optical Excitations in Molecular Crystals: Bound Excitons versus Free Electron-Hole Pairs in Anthracene},
Url = {https://link.aps.org/doi/10.1103/PhysRevLett.92.147402},
Volume = {92},
Year = {2004},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevLett.92.147402},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevLett.92.147402}}
@article{Hummer_2005,
Author = {Hummer, Kerstin and Ambrosch-Draxl, Claudia},
Doi = {10.1103/PhysRevB.71.081202},
Issue = {8},
Journal = {Phys. Rev. B},
Month = {Feb},
Numpages = {4},
Pages = {081202},
Publisher = {American Physical Society},
Title = {Oligoacene exciton binding energies: Their dependence on molecular size},
Url = {https://link.aps.org/doi/10.1103/PhysRevB.71.081202},
Volume = {71},
Year = {2005},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevB.71.081202},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevB.71.081202}}
@article{Cudazzo_2010,
Author = {Cudazzo, Pierluigi and Attaccalite, Claudio and Tokatly, Ilya V. and Rubio, Angel},
Doi = {10.1103/PhysRevLett.104.226804},
Issue = {22},
Journal = {Phys. Rev. Lett.},
Month = {Jun},
Numpages = {4},
Pages = {226804},
Publisher = {American Physical Society},
Title = {Strong Charge-Transfer Excitonic Effects and the Bose-Einstein Exciton Condensate in Graphane},
Url = {https://link.aps.org/doi/10.1103/PhysRevLett.104.226804},
Volume = {104},
Year = {2010},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevLett.104.226804},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevLett.104.226804}}
@article{Sharifzadeh_2013,
Author = {Sharifzadeh, Sahar and Darancet, Pierre and Kronik, Leeor and Neaton, Jeffrey B.},
Doi = {10.1021/jz401069f},
Eprint = {https://doi.org/10.1021/jz401069f},
Journal = {J. Phys. Chem. Lett.},
Number = {13},
Pages = {2197-2201},
Title = {Low-Energy Charge-Transfer Excitons in Organic Solids from First-Principles: The Case of Pentacene},
Url = {https://doi.org/10.1021/jz401069f},
Volume = {4},
Year = {2013},
Bdsk-Url-1 = {https://doi.org/10.1021/jz401069f}}
@article{Cudazzo_2013,
Author = {Cudazzo, Pierluigi and Gatti, Matteo and Rubio, Angel and Sottile, Francesco},
Doi = {10.1103/PhysRevB.88.195152},
Issue = {19},
Journal = {Phys. Rev. B},
Month = {Nov},
Numpages = {5},
Pages = {195152},
Publisher = {American Physical Society},
Title = {Frenkel versus charge-transfer exciton dispersion in molecular crystals},
Url = {https://link.aps.org/doi/10.1103/PhysRevB.88.195152},
Volume = {88},
Year = {2013},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevB.88.195152},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevB.88.195152}}
@article{Romaniello_2009,
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},
Eprint = {https://doi.org/10.1063/1.3065669},
Journal = {J. Chem. Phys.},
Number = {4},
Pages = {044108},
Title = {Double excitations in finite systems},
Url = {https://doi.org/10.1063/1.3065669},
Volume = {130},
Year = {2009},
Bdsk-Url-1 = {https://doi.org/10.1063/1.3065669}}
@article{Ma_2009,
Author = {Ma, Yuchen and Rohlfing, Michael and Molteni, Carla},
Doi = {10.1103/PhysRevB.80.241405},
Issue = {24},
Journal = {Phys. Rev. B},
Month = {Dec},
Numpages = {4},
Pages = {241405},
Publisher = {American Physical Society},
Title = {Excited states of biological chromophores studied using many-body perturbation theory: Effects of resonant-antiresonant coupling and dynamical screening},
Url = {https://link.aps.org/doi/10.1103/PhysRevB.80.241405},
Volume = {80},
Year = {2009},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevB.80.241405},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevB.80.241405}}
@article{Zhang_2013,
Author = {Zhang,Du and Steinmann,Stephan N. and Yang,Weitao},
Doi = {10.1063/1.4824907},
Eprint = {https://doi.org/10.1063/1.4824907},
Journal = {J. Chem. Phys.},
Number = {15},
Pages = {154109},
Title = {Dynamical second-order Bethe-Salpeter equation kernel: A method for electronic excitation beyond the adiabatic approximation},
Url = {https://doi.org/10.1063/1.4824907},
Volume = {139},
Year = {2013},
Bdsk-Url-1 = {https://doi.org/10.1063/1.4824907}}
@article{Rebolini_2016,
Author = {Rebolini,Elisa and Toulouse,Julien},
Doi = {10.1063/1.4943003},
Eprint = {https://doi.org/10.1063/1.4943003},
Journal = {J. Chem. Phys.},
Number = {9},
Pages = {094107},
Title = {Range-separated time-dependent density-functional theory with a frequency-dependent second-order Bethe-Salpeter correlation kernel},
Url = {https://doi.org/10.1063/1.4943003},
Volume = {144},
Year = {2016},
Bdsk-Url-1 = {https://doi.org/10.1063/1.4943003}}
@article{Olevano_2019,
Author = {Olevano,Valerio and Toulouse,Julien and Schuck,Peter},
Doi = {10.1063/1.5080330},
Eprint = {https://doi.org/10.1063/1.5080330},
Journal = {J. Chem. Phys.},
Number = {8},
Pages = {084112},
Title = {A formally exact one-frequency-only Bethe-Salpeter-like equation. Similarities and differences between GW+BSE and self-consistent RPA},
Url = {https://doi.org/10.1063/1.5080330},
Volume = {150},
Year = {2019},
Bdsk-Url-1 = {https://doi.org/10.1063/1.5080330}}
@article{Olovsson_2009,
Abstract = {We obtain x-ray absorption near-edge structures (XANES) by solving the equation of motion for the two-particle Green's function ... },
Author = {W Olovsson and I Tanaka and P Puschnig and C Ambrosch-Draxl},
Doi = {10.1088/0953-8984/21/10/104205},
Journal = {Journal of Physics: Condensed Matter},
Month = {feb},
Number = {10},
Pages = {104205},
Publisher = {{IOP} Publishing},
Title = {Near-edge structures from first principles all-electron Bethe{\textendash}Salpeter equation calculations},
Url = {https://doi.org/10.1088%2F0953-8984%2F21%2F10%2F104205},
Volume = {21},
Year = 2009,
Bdsk-Url-1 = {https://doi.org/10.1088%2F0953-8984%2F21%2F10%2F104205},
Bdsk-Url-2 = {https://doi.org/10.1088/0953-8984/21/10/104205}}
@article{Vinson_2011,
Author = {Vinson, J. and Rehr, J. J. and Kas, J. J. and Shirley, E. L.},
Doi = {10.1103/PhysRevB.83.115106},
Issue = {11},
Journal = {Phys. Rev. B},
Month = {Mar},
Numpages = {7},
Pages = {115106},
Publisher = {American Physical Society},
Title = {Bethe-Salpeter equation calculations of core excitation spectra},
Url = {https://link.aps.org/doi/10.1103/PhysRevB.83.115106},
Volume = {83},
Year = {2011},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevB.83.115106},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevB.83.115106}}
@article{Almlof_1991,
Abstract = {It is shown how the energy denominators encountered in various schemes for electronics structure calculation can be removed by a Laplace transform technique. The method is applicable to a wide variety of electronic structure calculations.},
Author = {Jan Alml{\"{o}}f},
Doi = {https://doi.org/10.1016/0009-2614(91)80078-C},
Issn = {0009-2614},
Journal = {Chem. Phys. Lett.},
Number = {4},
Pages = {319 - 320},
Title = {Elimination of energy denominators in M{\o}ller---Plesset perturbation theory by a Laplace transform approach},
Url = {http://www.sciencedirect.com/science/article/pii/000926149180078C},
Volume = {181},
Year = {1991},
Bdsk-Url-1 = {http://www.sciencedirect.com/science/article/pii/000926149180078C},
Bdsk-Url-2 = {https://doi.org/10.1016/0009-2614(91)80078-C}}
@article{Haser_1992,
Author = {H{\"{a}}ser,Marco and Alml{\"{o}}f,Jan},
Doi = {10.1063/1.462485},
Eprint = {https://doi.org/10.1063/1.462485},
Journal = {J. Chem. Phys.},
Number = {1},
Pages = {489-494},
Title = {Laplace transform techniques in M{\o}ller--Plesset perturbation theory},
Url = {https://doi.org/10.1063/1.462485},
Volume = {96},
Year = {1992},
Bdsk-Url-1 = {https://doi.org/10.1063/1.462485}}
@article{Rojas_1995,
Author = {Rojas, H. N. and Godby, R. W. and Needs, R. J.},
Doi = {10.1103/PhysRevLett.74.1827},
Issue = {10},
Journal = {Phys. Rev. Lett.},
Month = {Mar},
Numpages = {0},
Pages = {1827--1830},
Publisher = {American Physical Society},
Title = {Space-Time Method for Ab Initio Calculations of Self-Energies and Dielectric Response Functions of Solids},
Url = {https://link.aps.org/doi/10.1103/PhysRevLett.74.1827},
Volume = {74},
Year = {1995},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevLett.74.1827},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevLett.74.1827}}
@article{Walker_2006,
Author = {Walker, Brent and Saitta, A. Marco and Gebauer, Ralph and Baroni, Stefano},
Doi = {10.1103/PhysRevLett.96.113001},
Issue = {11},
Journal = {Phys. Rev. Lett.},
Month = {Mar},
Numpages = {4},
Pages = {113001},
Publisher = {American Physical Society},
Title = {Efficient Approach to Time-Dependent Density-Functional Perturbation Theory for Optical Spectroscopy},
Url = {https://link.aps.org/doi/10.1103/PhysRevLett.96.113001},
Volume = {96},
Year = {2006},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevLett.96.113001},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevLett.96.113001}}
@article{Bruneval_2008,
Author = {Bruneval, Fabien and Gonze, Xavier},
Doi = {10.1103/PhysRevB.78.085125},
Issue = {8},
Journal = {Phys. Rev. B},
Month = {Aug},
Numpages = {9},
Pages = {085125},
Publisher = {American Physical Society},
Title = {Accurate $GW$ self-energies in a plane-wave basis using only a few empty states: Towards large systems},
Url = {https://link.aps.org/doi/10.1103/PhysRevB.78.085125},
Volume = {78},
Year = {2008},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevB.78.085125},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevB.78.085125}}
@article{Fuchs_2008,
Author = {Fuchs, F. and R\"odl, C. and Schleife, A. and Bechstedt, F.},
Doi = {10.1103/PhysRevB.78.085103},
Issue = {8},
Journal = {Phys. Rev. B},
Month = {Aug},
Numpages = {13},
Pages = {085103},
Publisher = {American Physical Society},
Title = {Efficient $\mathcal{O}({N}^{2})$ approach to solve the Bethe-Salpeter equation for excitonic bound states},
Url = {https://link.aps.org/doi/10.1103/PhysRevB.78.085103},
Volume = {78},
Year = {2008},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevB.78.085103},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevB.78.085103}}
@article{Giustino_2010,
Author = {Giustino, Feliciano and Cohen, Marvin L. and Louie, Steven G.},
Doi = {10.1103/PhysRevB.81.115105},
Issue = {11},
Journal = {Phys. Rev. B},
Month = {Mar},
Numpages = {17},
Pages = {115105},
Publisher = {American Physical Society},
Title = {GW method with the self-consistent Sternheimer equation},
Url = {https://link.aps.org/doi/10.1103/PhysRevB.81.115105},
Volume = {81},
Year = {2010},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevB.81.115105},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevB.81.115105}}
@article{Umari_2010,
Author = {Umari, P. and Stenuit, Geoffrey and Baroni, Stefano},
Doi = {10.1103/PhysRevB.81.115104},
Issue = {11},
Journal = {Phys. Rev. B},
Month = {Mar},
Numpages = {5},
Pages = {115104},
Publisher = {American Physical Society},
Title = {GW quasiparticle spectra from occupied states only},
Url = {https://link.aps.org/doi/10.1103/PhysRevB.81.115104},
Volume = {81},
Year = {2010},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevB.81.115104},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevB.81.115104}}
@article{Ljungberg_2015,
Author = {Ljungberg, M. P. and Koval, P. and Ferrari, F. and Foerster, D. and S\'anchez-Portal, D.},
Doi = {10.1103/PhysRevB.92.075422},
Issue = {7},
Journal = {Phys. Rev. B},
Month = {Aug},
Numpages = {18},
Pages = {075422},
Publisher = {American Physical Society},
Title = {Cubic-scaling iterative solution of the Bethe-Salpeter equation for finite systems},
Url = {https://link.aps.org/doi/10.1103/PhysRevB.92.075422},
Volume = {92},
Year = {2015},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevB.92.075422},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevB.92.075422}}
@article{Seeger_1977,
Author = {Seeger,Rolf and Pople,John A.},
Doi = {10.1063/1.434318},
Eprint = {https://doi.org/10.1063/1.434318},
Journal = {J. Chem. Phys.},
Number = {7},
Pages = {3045-3050},
Title = {Self‐consistent molecular orbital methods. XVIII. Constraints and stability in Hartree--Fock theory},
Url = {https://doi.org/10.1063/1.434318},
Volume = {66},
Year = {1977},
Bdsk-Url-1 = {https://doi.org/10.1063/1.434318}}
@article{Bauernschmitt_1996,
Author = {Bauernschmitt,R{\"u}diger and Ahlrichs,Reinhart},
Doi = {10.1063/1.471637},
Eprint = {https://doi.org/10.1063/1.471637},
Journal = {J. Chem. Phys.},
Number = {22},
Pages = {9047-9052},
Title = {Stability analysis for solutions of the closed shell Kohn--Sham equation},
Url = {https://doi.org/10.1063/1.471637},
Volume = {104},
Year = {1996},
Bdsk-Url-1 = {https://doi.org/10.1063/1.471637}}
@article{Sears_2011,
Author = {Sears,John S. and Koerzdoerfer,Thomas and Zhang,Cai-Rong and Br{\'{e}}das,Jean-Luc},
Doi = {10.1063/1.3656734},
Eprint = {https://doi.org/10.1063/1.3656734},
Journal = {J. Chem. Phys.},
Number = {15},
Pages = {151103},
Title = {Communication: Orbital instabilities and triplet states from time-dependent density functional theory and long-range corrected functionals},
Url = {https://doi.org/10.1063/1.3656734},
Volume = {135},
Year = {2011},
Bdsk-Url-1 = {https://doi.org/10.1063/1.3656734}}
@article{Jacquemin_2017b,
Author = {Jacquemin, Denis and Duchemin, Ivan and Blondel, Aymeric and Blase, Xavier},
Doi = {10.1021/acs.jctc.6b01169},
Eprint = {https://doi.org/10.1021/acs.jctc.6b01169},
Journal = {J. Chem. Theory Comput.},
Note = {PMID: 28107000},
Number = {2},
Pages = {767-783},
Title = {Benchmark of Bethe-Salpeter for Triplet Excited-States},
Url = {https://doi.org/10.1021/acs.jctc.6b01169},
Volume = {13},
Year = {2017},
Bdsk-Url-1 = {https://doi.org/10.1021/acs.jctc.6b01169}}
@article{Rangel_2017,
Author = {Rangel,Tonatiuh and Hamed,Samia M. and Bruneval,Fabien and Neaton,Jeffrey B.},
Doi = {10.1063/1.4983126},
Eprint = {https://doi.org/10.1063/1.4983126},
Journal = {J. Chem. Phys.},
Number = {19},
Pages = {194108},
Title = {An assessment of low-lying excitation energies and triplet instabilities of organic molecules with an ab initio Bethe-Salpeter equation approach and the Tamm-Dancoff approximation},
Url = {https://doi.org/10.1063/1.4983126},
Volume = {146},
Year = {2017},
Bdsk-Url-1 = {https://doi.org/10.1063/1.4983126}}
@article{Holzer_2018a,
Author = {Holzer,Christof and Klopper,Wim},
Date-Modified = {2020-04-16 20:50:52 +0200},
Doi = {10.1063/1.5051028},
Eprint = {https://doi.org/10.1063/1.5051028},
Journal = {J. Chem. Phys.},
Number = {10},
Pages = {101101},
Title = {Communication: A hybrid Bethe--Salpeter/time-dependent density-functional-theory approach for excitation energies},
Url = {https://doi.org/10.1063/1.5051028},
Volume = {149},
Year = {2018},
Bdsk-Url-1 = {https://doi.org/10.1063/1.5051028}}
@article{Olsen_2014,
Author = {Olsen,Thomas and Thygesen,Kristian S.},
Doi = {10.1063/1.4871875},
Eprint = {https://doi.org/10.1063/1.4871875},
Journal = {J. Chem. Phys.},
Number = {16},
Pages = {164116},
Title = {Static correlation beyond the random phase approximation: Dissociating H2 with the Bethe-Salpeter equation and time-dependent GW},
Url = {https://doi.org/10.1063/1.4871875},
Volume = {140},
Year = {2014},
Bdsk-Url-1 = {https://doi.org/10.1063/1.4871875}}
@article{Holzer_2018b,
Author = {Holzer, Christof and Gui, Xin and Harding, Michael E. and Kresse, Georg and Helgaker, Trygve and Klopper, Wim},
Date-Modified = {2020-04-16 20:51:13 +0200},
Doi = {10.1063/1.5047030},
Eprint = {https://doi.org/10.1063/1.5047030},
Journal = {J. Chem. Phys.},
Number = {14},
Pages = {144106},
Title = {Bethe-Salpeter correlation energies of atoms and molecules},
Url = {https://doi.org/10.1063/1.5047030},
Volume = {149},
Year = {2018},
Bdsk-Url-1 = {https://doi.org/10.1063/1.5047030}}
@article{Li_2020,
Author = {Jing Li and Ivan Duchemin and Xavier Blase and Valerio Olevano},
Doi = {10.21468/SciPostPhys.8.2.020},
Issue = {2},
Journal = {SciPost Phys.},
Pages = {20},
Publisher = {SciPost},
Title = {{Ground-state correlation energy of beryllium dimer by the Bethe-Salpeter equation}},
Url = {https://scipost.org/10.21468/SciPostPhys.8.2.020},
Volume = {8},
Year = {2020},
Bdsk-Url-1 = {https://scipost.org/10.21468/SciPostPhys.8.2.020},
Bdsk-Url-2 = {https://doi.org/10.21468/SciPostPhys.8.2.020}}
@article{Loos_2020,
Author = {Pierre-Fran{\c c}ois Loos and Anthony Scemama and Ivan Duchemin and Denis Jacquemin and Xavier Blase},
Title = {{ Pros and Cons of the Bethe-Salpeter Formalism for Ground-State Energies }},
Year = {2020}}
@article{Kaczmarski_2010,
Author = {Kaczmarski, Marcin S. and Ma, Yuchen and Rohlfing, Michael},
Doi = {10.1103/PhysRevB.81.115433},
Issue = {11},
Journal = {Phys. Rev. B},
Month = {Mar},
Numpages = {9},
Pages = {115433},
Publisher = {American Physical Society},
Title = {Diabatic states of a photoexcited retinal chromophore from ab initio many-body perturbation theory},
Url = {https://link.aps.org/doi/10.1103/PhysRevB.81.115433},
Volume = {81},
Year = {2010},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevB.81.115433},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevB.81.115433}}
@article{Rangel_2016,
Author = {Rangel, Tonatiuh and Hamed, Samia M. and Bruneval, Fabien and Neaton, Jeffrey B.},
Doi = {10.1021/acs.jctc.6b00163},
Eprint = {https://doi.org/10.1021/acs.jctc.6b00163},
Journal = {J. Chem. Theory Comput.},
Note = {PMID: 27123935},
Number = {6},
Pages = {2834-2842},
Title = {Evaluating the GW Approximation with CCSD(T) for Charged Excitations Across the Oligoacenes},
Url = {https://doi.org/10.1021/acs.jctc.6b00163},
Volume = {12},
Year = {2016},
Bdsk-Url-1 = {https://doi.org/10.1021/acs.jctc.6b00163}}
@article{Bruneval_2013,
Author = {Bruneval, Fabien and Marques, Miguel A. L.},
Doi = {10.1021/ct300835h},
Eprint = {https://doi.org/10.1021/ct300835h},
Journal = {J. Chem. Theory Comput.},
Note = {PMID: 26589035},
Number = {1},
Pages = {324-329},
Title = {Benchmarking the Starting Points of the GW Approximation for Molecules},
Url = {https://doi.org/10.1021/ct300835h},
Volume = {9},
Year = {2013},
Bdsk-Url-1 = {https://doi.org/10.1021/ct300835h}}
@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},
Doi = {10.1021/acs.jctc.5b00871},
Eprint = {https://doi.org/10.1021/acs.jctc.5b00871},
Journal = {J. Chem. Theory Comput.},
Note = {PMID: 26731609},
Number = {2},
Pages = {615-626},
Title = {Accurate Ionization Potentials and Electron Affinities of Acceptor Molecules III: A Benchmark of GW Methods},
Url = {https://doi.org/10.1021/acs.jctc.5b00871},
Volume = {12},
Year = {2016},
Bdsk-Url-1 = {https://doi.org/10.1021/acs.jctc.5b00871}}
@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},
Eprint = {https://doi.org/10.1021/acs.jctc.5b01238},
Journal = {J. Chem. Theory Comput.},
Note = {PMID: 27168352},
Number = {6},
Pages = {2528-2541},
Title = {Quasi-Particle Self-Consistent GW for Molecules},
Url = {https://doi.org/10.1021/acs.jctc.5b01238},
Volume = {12},
Year = {2016},
Bdsk-Url-1 = {https://doi.org/10.1021/acs.jctc.5b01238}}
@article{Caruso_2016,
Author = {Caruso, Fabio and Dauth, Matthias and van Setten, Michiel J. and Rinke, Patrick},
Doi = {10.1021/acs.jctc.6b00774},
Eprint = {https://doi.org/10.1021/acs.jctc.6b00774},
Journal = {Journal of Chemical Theory and Computation},
Note = {PMID: 27631585},
Number = {10},
Pages = {5076-5087},
Title = {Benchmark of GW Approaches for the GW100 Test Set},
Url = {https://doi.org/10.1021/acs.jctc.6b00774},
Volume = {12},
Year = {2016},
Bdsk-Url-1 = {https://doi.org/10.1021/acs.jctc.6b00774}}
@article{Korbel_2014,
Author = {K{\"{o}}rbel, Sabine and Boulanger, Paul and Duchemin, Ivan and Blase, Xavier and Marques, Miguel A. L. and Botti, Silvana},
Doi = {10.1021/ct5003658},
Eprint = {https://doi.org/10.1021/ct5003658},
Journal = {J. Chem. Theory Comput.},
Note = {PMID: 26588537},
Number = {9},
Pages = {3934-3943},
Title = {Benchmark Many-Body GW and Bethe--Salpeter Calculations for Small Transition Metal Molecules},
Url = {https://doi.org/10.1021/ct5003658},
Volume = {10},
Year = {2014},
Bdsk-Url-1 = {https://doi.org/10.1021/ct5003658}}
@article{Blase_2011b,
Author = {Blase,X. and Attaccalite,C.},
Doi = {10.1063/1.3655352},
Eprint = {https://doi.org/10.1063/1.3655352},
Journal = {Appl. Phys. Lett.},
Number = {17},
Pages = {171909},
Title = {Charge-Transfer Excitations in Molecular Donor-Acceptor Complexes within the Many-Body Bethe-Salpeter Approach},
Url = {https://doi.org/10.1063/1.3655352},
Volume = {99},
Year = {2011},
Bdsk-Url-1 = {https://doi.org/10.1063/1.3655352}}
@article{Stein_2009,
Author = {Stein, Tamar and Kronik, Leeor and Baer, Roi},
Doi = {10.1021/ja8087482},
Eprint = {https://doi.org/10.1021/ja8087482},
Journal = {J. Am. Chem. Soc.},
Note = {PMID: 19239266},
Number = {8},
Pages = {2818-2820},
Title = {Reliable Prediction of Charge Transfer Excitations in Molecular Complexes Using Time-Dependent Density Functional Theory},
Url = {https://doi.org/10.1021/ja8087482},
Volume = {131},
Year = {2009},
Bdsk-Url-1 = {https://doi.org/10.1021/ja8087482}}
@article{Garniron_2018,
Author = {Y. Garniron and A. Scemama and E. Giner and M. Caffarel and P. F. Loos},
Date-Added = {2018-11-29 14:23:11 +0100},
Date-Modified = {2018-11-29 14:23:11 +0100},
Doi = {10.1063/1.5044503},
Journal = {J. Chem. Phys.},
Pages = {064103},
Title = {Selected Configuration Interaction Dressed by Perturbation},
Volume = {149},
Year = {2018},
Bdsk-Url-1 = {https://doi.org/10.1063/1.5044503}}
@article{Botti_2004,
Author = {Botti, Silvana and Sottile, Francesco and Vast, Nathalie and Olevano, Valerio and Reining, Lucia and Weissker, Hans-Christian and Rubio, Angel and Onida, Giovanni and Del Sole, Rodolfo and Godby, R. W.},
Doi = {10.1103/PhysRevB.69.155112},
Issue = {15},
Journal = {Phys. Rev. B},
Month = {Apr},
Numpages = {14},
Pages = {155112},
Publisher = {American Physical Society},
Title = {Long-Range Contribution to the Exchange-Correlation Kernel of Time-Dependent Density Functional Theory},
Url = {https://link.aps.org/doi/10.1103/PhysRevB.69.155112},
Volume = {69},
Year = {2004},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevB.69.155112},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevB.69.155112}}
@article{Kaltak_2014,
Author = {Kaltak, Merzuk and Klime\v{s}, Ji\v{i}\'{i} and Kresse, Georg},
Doi = {10.1021/ct5001268},
Eprint = {https://doi.org/10.1021/ct5001268},
Journal = {Journal of Chemical Theory and Computation},
Note = {PMID: 26580770},
Number = {6},
Pages = {2498-2507},
Title = {Low Scaling Algorithms for the Random Phase Approximation: Imaginary Time and Laplace Transformations},
Url = {https://doi.org/10.1021/ct5001268},
Volume = {10},
Year = {2014},
Bdsk-Url-1 = {https://doi.org/10.1021/ct5001268}}
@article{Liu_2016,
Author = {Liu, Peitao and Kaltak, Merzuk and Klime\ifmmode \check{s}\else \v{s}\fi{}, Ji\ifmmode \check{r}\else \v{r}\fi{}\'{\i} and Kresse, Georg},
Doi = {10.1103/PhysRevB.94.165109},
Issue = {16},
Journal = {Phys. Rev. B},
Month = {Oct},
Numpages = {13},
Pages = {165109},
Publisher = {American Physical Society},
Title = {Cubic Scaling $GW$: Towards Fast Quasiparticle Calculations},
Url = {https://link.aps.org/doi/10.1103/PhysRevB.94.165109},
Volume = {94},
Year = {2016},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevB.94.165109},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevB.94.165109}}
@article{Duchemin_2019,
Author = {Duchemin,Ivan and Blase,Xavier},
Doi = {10.1063/1.5090605},
Eprint = {https://doi.org/10.1063/1.5090605},
Journal = {J. Chem. Phys.},
Number = {17},
Pages = {174120},
Title = {Separable resolution-of-the-identity with all-electron Gaussian bases: Application to cubic-scaling RPA},
Url = {https://doi.org/10.1063/1.5090605},
Volume = {150},
Year = {2019},
Bdsk-Url-1 = {https://doi.org/10.1063/1.5090605}}
@article{Lu_2017,
Abstract = {We present a new cubic scaling algorithm for the calculation of the RPA correlation energy. Our scheme splits up the dependence between the occupied and virtual orbitals in χ0 by use of Cauchy's integral formula. This introduces an additional integral to be carried out, for which we provide a geometrically convergent quadrature rule. Our scheme also uses the newly developed Interpolative Separable Density Fitting algorithm to further reduce the computational cost in a way analogous to that of the Resolution of Identity method.},
Author = {Jianfeng Lu and Kyle Thicke},
Doi = {https://doi.org/10.1016/j.jcp.2017.09.012},
Issn = {0021-9991},
Journal = {J. Comput. Phys.},
Keywords = {Electronic structure theory, Density fitting, Random phase approximation, Fast algorithms, Contour integral},
Pages = {187 - 202},
Title = {Cubic Scaling Algorithms for RPA Correlation Using Interpolative Separable Density Fitting},
Url = {http://www.sciencedirect.com/science/article/pii/S002199911730671X},
Volume = {351},
Year = {2017},
Bdsk-Url-1 = {http://www.sciencedirect.com/science/article/pii/S002199911730671X},
Bdsk-Url-2 = {https://doi.org/10.1016/j.jcp.2017.09.012}}
@article{Yabana_1996,
Author = {Yabana, K. and Bertsch, G. F.},
Doi = {10.1103/PhysRevB.54.4484},
Issue = {7},
Journal = {Phys. Rev. B},
Month = {Aug},
Numpages = {0},
Pages = {4484--4487},
Publisher = {American Physical Society},
Title = {Time-Dependent Local-Density Approximation in Real Time},
Url = {https://link.aps.org/doi/10.1103/PhysRevB.54.4484},
Volume = {54},
Year = {1996},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevB.54.4484},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevB.54.4484}}
@article{Rabani_2015,
Author = {Rabani, Eran and Baer, Roi and Neuhauser, Daniel},
Doi = {10.1103/PhysRevB.91.235302},
Issue = {23},
Journal = {Phys. Rev. B},
Month = {Jun},
Numpages = {10},
Pages = {235302},
Publisher = {American Physical Society},
Title = {Time-Dependent Stochastic Bethe-Salpeter Approach},
Url = {https://link.aps.org/doi/10.1103/PhysRevB.91.235302},
Volume = {91},
Year = {2015},
Bdsk-Url-1 = {https://link.aps.org/doi/10.1103/PhysRevB.91.235302},
Bdsk-Url-2 = {https://doi.org/10.1103/PhysRevB.91.235302}}
@article{Elliott_2019,
Author = {Elliott, Joshua D. and Colonna, Nicola and Marsili, Margherita and Marzari, Nicola and Umari, Paolo},
Doi = {10.1021/acs.jctc.8b01271},
Eprint = {https://doi.org/10.1021/acs.jctc.8b01271},
Journal = {J. Chem. Theory Comput.},
Note = {PMID: 30998361},
Number = {6},
Pages = {3710-3720},
Title = {Koopmans Meets Bethe--Salpeter: Excitonic Optical Spectra without GW},
Url = {https://doi.org/10.1021/acs.jctc.8b01271},
Volume = {15},
Year = {2019},
Bdsk-Url-1 = {https://doi.org/10.1021/acs.jctc.8b01271}}
@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},
Eprint = {https://doi.org/10.1021/acs.jctc.7b00770},
Journal = {J. Chem. Theory Comput.},
Note = {PMID: 28876912},
Number = {10},
Pages = {4997-5003},
Title = {Stochastic GW Calculations for Molecules},
Url = {https://doi.org/10.1021/acs.jctc.7b00770},
Volume = {13},
Year = {2017},
Bdsk-Url-1 = {https://doi.org/10.1021/acs.jctc.7b00770}}
@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},
Eprint = {https://doi.org/10.1021/acs.jpclett.7b02740},
Journal = {The Journal of Physical Chemistry Letters},
Note = {PMID: 29280376},
Number = {2},
Pages = {306-312},
Title = {Toward GW Calculations on Thousands of Atoms},
Url = {https://doi.org/10.1021/acs.jpclett.7b02740},
Volume = {9},
Year = {2018},
Bdsk-Url-1 = {https://doi.org/10.1021/acs.jpclett.7b02740}}
@article{Foerster_2011,
Author = {Foerster,D. and Koval,P. and S{\'a}nchez-Portal,D.},
Doi = {10.1063/1.3624731},
Eprint = {https://doi.org/10.1063/1.3624731},
Journal = {J. Chem. Phys.},
Number = {7},
Pages = {074105},
Title = {An O(N3) implementation of Hedin's GW approximation for molecules},
Url = {https://doi.org/10.1063/1.3624731},
Volume = {135},
Year = {2011},
Bdsk-Url-1 = {https://doi.org/10.1063/1.3624731}}
@article{Gao_2020,
Author = {Gao, Weiwei and Chelikowsky, James R.},
Doi = {10.1021/acs.jctc.9b01025},
Eprint = {https://doi.org/10.1021/acs.jctc.9b01025},
Journal = {J. Chem. Theory Comput.},
Note = {PMID: 32074452},
Number = {4},
Pages = {2216-2223},
Title = {Accelerating Time-Dependent Density Functional Theory and GW Calculations for Molecules and Nanoclusters with Symmetry Adapted Interpolative Separable Density Fitting},
Url = {https://doi.org/10.1021/acs.jctc.9b01025},
Volume = {16},
Year = {2020},
Bdsk-Url-1 = {https://doi.org/10.1021/acs.jctc.9b01025}}
Reference in New Issue View Git Blame Copy Permalink