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\begin{etaremune}
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\item
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\href{https://arxiv.org/pdf/2310.19768.pdf}{Heptazine, cyclazine, and related compounds: chemically-accurate estimates of the inverted singlet-triplet gap},\\
|
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\textbf{P. F. Loos}, F. Lipparini, and D. Jacquemin*,\\
|
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\textit{J. Phys. Chem. Lett.} (submitted).
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\href{https://arxiv.org/pdf/2403.19597.pdf}{Reference energies for double excitations: improvement \& extension},\\
|
||||
F. Kossoski*, M. Boggio-Pasqua*, \textbf{P. F. Loos*}, and D. Jacquemin*,\\
|
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\textit{J. Chem. Theory Comput.} (submitted).
|
||||
|
||||
\item
|
||||
\href{https://arxiv.org/pdf/2309.17311.pdf}{Reference vertical excitation energies for transition metal compounds},\\
|
||||
D. Jacquemin*, F. Kossoski, F. Gam, M. Boggio-Pasqua*, and \textbf{P. F. Loos*},\\
|
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\item
|
||||
\href{https://arxiv.org/pdf/2402.16414.pdf}{Cumulant Green's function methods for molecules},\\
|
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\textbf{P. F. Loos*}, A. Marie, and A. Ammar,\\
|
||||
\textit{Faraday Discuss.} (submitted).
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|
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\item
|
||||
\href{https://arxiv.org/pdf/2402.13877.pdf}{Reference energies for valence ionizations and satellite transitions},\\
|
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A. Marie* and \textbf{P. F. Loos*},\\
|
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\textit{J. Chem. Theory Comput.} (in press).
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||||
|
||||
\item
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||||
\href{https://arxiv.org/pdf/2402.13111.pdf}{Go green: selected configuration interaction as a more sustainable alternative for high accuracy},\\
|
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\textbf{P. F. Loos*}, Y. Damour, A. Ammar, M. Caffarel, F. Kossoski, and A. Scemama,\\
|
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\textit{J. Phys. Chem. A} (submitted).
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||||
|
||||
\item
|
||||
\href{https://arxiv.org/pdf/2309.04167.pdf}{The three channels of many-body perturbation theory: GW, particle-particle, and electron-hole T-matrix self-energies},\\
|
||||
\href{https://arxiv.org/pdf/2401.13809.pdf}{A mountaineering strategy to excited states: accurate vertical transition energies and benchmarks for substituted benzenes},\\
|
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\textbf{P. F. Loos} and D. Jacquemin*,\\
|
||||
\textit{J. Comput. Chem.} (in press).
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|
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\item
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||||
\href{https://arxiv.org/pdf/2401.05048.pdf}{State-specific coupled-cluster methods for excited states},\\
|
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Y. Damour*, A. Scemama, D. Jacquemin, F. Kossoski*, and \textbf{P. F. Loos*},\\
|
||||
\textit{J. Chem. Theory Comput.} (in press).
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|
||||
\item
|
||||
\href{https://arxiv.org/pdf/2401.04685.pdf}{Neutral electronic excitations and derivative discontinuities: An extended N-centered ensemble density functional theory perspective},\\
|
||||
F. Cernatic, \textbf{P. F. Loos}, B. Senjean, and E. Fromager*,\\
|
||||
\textit{Phys. Rev. B} (submitted).
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|
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\item
|
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\href{https://pfloos.github.io/WEB_LOOS/pub/135.pdf}{Can $GW$ handle multireference systems?},\\
|
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A. Ammar, A. Marie, M. Rodríguez-Mayorga, H. G. A. Burton, and \textbf{P. F. Loos*},\\
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\textit{J. Chem. Phys.}, 114101 (2024).
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|
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\item
|
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\href{https://pfloos.github.io/WEB_LOOS/pub/134.pdf}{Rationale for the extrapolation procedure in selected configuration interaction},\\
|
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H. G. A. Burton* and \textbf{P. F. Loos*},\\
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\textit{J. Chem. Phys.}, \textbf{2024}, \textit{160}, 104102.
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|
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\item
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\href{https://arxiv.org/pdf/2311.05351.pdf}{The $GW$ approximation: a quantum chemistry perspective},\\
|
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A. Marie, A. Ammar, and \textbf{P. F. Loos*},\\
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\textit{Adv. Quantum Chem.} (in press).
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|
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\item
|
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\href{https://pfloos.github.io/WEB_LOOS/pub/132.pdf}{Heptazine, cyclazine, and related compounds: chemically-accurate estimates of the inverted singlet-triplet gap},\\
|
||||
\textbf{P. F. Loos}, F. Lipparini, and D. Jacquemin*,\\
|
||||
\textit{J. Phys. Chem. Lett.}, \textbf{2023}, \textit{14}, 11069.
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|
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\item
|
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\href{https://pfloos.github.io/WEB_LOOS/pub/131.pdf}{Reference vertical excitation energies for transition metal compounds},\\
|
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D. Jacquemin*, F. Kossoski, F. Gam, M. Boggio-Pasqua*, and \textbf{P. F. Loos*},\\
|
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\textit{J. Chem. Theory Comput.}, \textbf{2023}, \textit{19}, 8782.
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|
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\item
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\href{https://pfloos.github.io/WEB_LOOS/pub/130.pdf}{The three channels of many-body perturbation theory: GW, particle-particle, and electron-hole T-matrix self-energies},\\
|
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R. Orlando, P. Romaniello*, and \textbf{P. F. Loos*},\\
|
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\textit{J. Chem. Phys.} (in press).
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\textit{J. Chem. Phys.}, \textbf{2023}, \textit{159}, 184113.
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|
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\item
|
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\href{https://arxiv.org/pdf/2308.14890.pdf}{QCMATH: Mathematica modules for electronic structure calculations},\\
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E. Monino, A. Marie, and \textbf{P. F. Loos*},\\
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\textit{arXiv}, 2308.14890 [physics.chem-p] (2023).
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\item
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\href{https://arxiv.org/pdf/2308.14618.pdf}{Seniority and hierarchy configuration interaction for radicals and excited states},\\
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\href{https://pfloos.github.io/WEB_LOOS/pub/129.pdf}{Seniority and hierarchy configuration interaction for radicals and excited states},\\
|
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F. Kossoski* and \textbf{P. F. Loos*},\\
|
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\textit{J. Chem. Theory Comput.} (in press).
|
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\textit{J. Chem. Theory Comput.}, \textbf{2023}, \textit{19}, 8654.
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|
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\item
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\href{https://pfloos.github.io/WEB_LOOS/pub/128.pdf}{Introduction to the Peter M. W. Gill special issue},\\
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|
|
@ -70,71 +118,71 @@
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\textit{Mol. Phys.}, \textbf{2023}, \textit{121}, e2219934.
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\item
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\href{https://www.irsamc.ups-tlse.fr/loos/pub/127.pdf}{Equation generator for equation-of-motion coupled cluster assisted by computer algebra system},\\
|
||||
\href{https://pfloos.github.io/WEB_LOOS/pub/127.pdf}{Equation generator for equation-of-motion coupled cluster assisted by computer algebra system},\\
|
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R. Quintero-Monsebaiz and \textbf{P. F. Loos*},\\
|
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\textit{AIP Adv.}, \textbf{2023}, \textit{13}, 085035.
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|
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\item
|
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\href{https://www.irsamc.ups-tlse.fr/loos/pub/126.pdf}{Connections and performances of Green’s function methods for charged and neutral excitations},\\
|
||||
\href{https://pfloos.github.io/WEB_LOOS/pub/126.pdf}{Connections and performances of Green’s function methods for charged and neutral excitations},\\
|
||||
E. Monino and \textbf{P. F. Loos*},\\
|
||||
\textit{J. Chem. Phys.}, \textbf{2023}, \textit{159}, 034105.
|
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|
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\item
|
||||
\href{https://www.irsamc.ups-tlse.fr/loos/pub/125.pdf}{Exact excited-state functionals of the asymmetric Hubbard dimer},\\
|
||||
S. Giarrusso and \textbf{P. F. Loos*},\\
|
||||
\href{https://pfloos.github.io/WEB_LOOS/pub/125.pdf}{Exact excited-state functionals of the asymmetric Hubbard dimer},\\
|
||||
S. Giarrusso* and \textbf{P. F. Loos*},\\
|
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\textit{J. Phys. Chem. Lett.}, \textbf{2023}, \textit{14}, 8780.
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|
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\item
|
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\href{https://www.irsamc.ups-tlse.fr/loos/pub/124.pdf}{A similarity renormalization group approach to Green’s function methods},\\
|
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\href{https://pfloos.github.io/WEB_LOOS/pub/124.pdf}{A similarity renormalization group approach to Green’s function methods},\\
|
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A. Marie* and \textbf{P. F. Loos*},\\
|
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\textit{J. Chem. Theory Comput.}, \textbf{2023}, \textit{19}, 3943.
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|
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\item
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\href{https://www.irsamc.ups-tlse.fr/loos/pub/123.pdf}{Exploring new exchange-correlation kernels in the Bethe-Salpeter equation: a study of the asymmetric Hubbard dimer},\\
|
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\href{https://pfloos.github.io/WEB_LOOS/pub/123.pdf}{Exploring new exchange-correlation kernels in the Bethe-Salpeter equation: a study of the asymmetric Hubbard dimer},\\
|
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R. Orlando, P. Romaniello, and \textbf{P. F. Loos*},\\
|
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\textit{Adv. Quantum Chem.}, \textbf{2023}, \textit{88}, 183.
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|
||||
\item
|
||||
\href{https://www.irsamc.ups-tlse.fr/loos/pub/122.pdf}{Ground- and excited-state dipole moments and oscillator strengths of full configuration interaction quality},\\
|
||||
\href{https://pfloos.github.io/WEB_LOOS/pub/122.pdf}{Ground- and excited-state dipole moments and oscillator strengths of full configuration interaction quality},\\
|
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Y. Damour*, R. Quintero-Monsebaiz, M. Caffarel, D. Jacquemin, F. Kossoski, A. Scemama, and \textbf{P. F. Loos*},\\
|
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\textit{J. Chem. Theory Comput.}, \textbf{2023}, \textit{19}, 221.
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|
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\item
|
||||
\href{https://www.irsamc.ups-tlse.fr/loos/pub/121.pdf}{State-specific configuration interaction for excited states},\\
|
||||
\href{https://pfloos.github.io/WEB_LOOS/pub/121.pdf}{State-specific configuration interaction for excited states},\\
|
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F. Kossoski* and \textbf{P. F. Loos*},\\
|
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\textit{J. Chem. Theory Comput.}, \textbf{2022}, \textit{19} 2258.
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|
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\item
|
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\href{https://www.irsamc.ups-tlse.fr/loos/pub/120.pdf}{Diffusion Monte Carlo using domains in configuration space},\\
|
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\href{https://pfloos.github.io/WEB_LOOS/pub/120.pdf}{Diffusion Monte Carlo using domains in configuration space},\\
|
||||
R. Assaraf, E. Giner, V. G. Chilkuri, \textbf{P. F. Loos}, A. Scemama, and M. Caffarel*,\\
|
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\textit{Phys. Rev. B}, \textbf{2023}, \textit{107}, 035130.
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|
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\item
|
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\href{https://www.irsamc.ups-tlse.fr/loos/pub/119.pdf}{Connections between many-body perturbation and coupled-cluster theories},\\
|
||||
\href{https://pfloos.github.io/WEB_LOOS/pub/119.pdf}{Connections between many-body perturbation and coupled-cluster theories},\\
|
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R. Quintero-Monsebaiz, E. Monino, A. Marie, and \textbf{P. F. Loos*},\\
|
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\textit{J. Chem. Phys.}, \textbf{2022}, \textit{157}, 231102.
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\item \href{https://www.irsamc.ups-tlse.fr/loos/pub/118.pdf}{DFT exchange: sharing perspectives on the workhorse of quantum chemistry and materials science},\\
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\item \href{https://pfloos.github.io/WEB_LOOS/pub/118.pdf}{DFT exchange: sharing perspectives on the workhorse of quantum chemistry and materials science},\\
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A. M. Teale,* T. Helgaker,* A. Savin,* C. Adamo, B. Aradi, A. V. Arbuznikov, P. W. Ayers, E. J. Baerends, V. Barone, P. Calaminici, E. Cancès, E. A. Carter, P. K. Chattaraj, H. Chermette, I. Ciofini, T. D. Crawford, F. De Proft, J. F. Dobson, C. Draxl, T. Frauenheim, E. Fromager, P. Fuentealba, L. Gagliardi, G. Galli, J. Gao, P. Geerlings, N. Gidopoulos, P. M. W. Gill, P. Gori-Giorgi, A. Görling, T. Gould, S. Grimme, O. Gritsenko, H. J. A. Jensen, E. R. Johnson, R. O. Jones, M. Kaupp, A. M. Köster, L. Kronik, A. I. Krylov, S. Kvaal, A. Laestadius, M. Levy, M. Lewin, S. Liu, \textbf{P. F. Loos}, N. T. Maitra, F. Neese, J. P. Perdew, K. Pernal, P. Pernot, P. Piecuch, E. Rebolini, L. Reining, P. Romaniello, A. Ruzsinszky, D. R. Salahub, M. Scheffler, P. Schwerdtfeger, V. N. Staroverov, J. Sun, E. Tellgren, D. J. Tozer, S. B. Trickey, C. A. Ullrich, A. Vela, G. Vignale, T. A. Wesolowski, W. Yang, and X. Xu.\\
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\textit{Phys. Chem. Chem. Phys.}, \textbf{2022}, \textit{24}, 28700.
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\item
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\href{https://www.irsamc.ups-tlse.fr/loos/pub/117.pdf}{A mountaineering strategy to excited states: revising reference values with EOM-CC4},\\
|
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\href{https://pfloos.github.io/WEB_LOOS/pub/117.pdf}{A mountaineering strategy to excited states: revising reference values with EOM-CC4},\\
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\textbf{P. F. Loos*}, F. Lipparini, D. A. Matthews, A. Blondel, and D. Jacquemin*,\\
|
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\textit{J. Chem. Theory Comput.}, \textbf{2022}, \textit{18}, 4418.
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\item
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\href{https://www.irsamc.ups-tlse.fr/loos/pub/116.pdf}{Benchmarking CASPT3 vertical excitation energies},\\
|
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\href{https://pfloos.github.io/WEB_LOOS/pub/116.pdf}{Benchmarking CASPT3 vertical excitation energies},\\
|
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M. Boggio-Pasqua*, D. Jacquemin*, and \textbf{P. F. Loos*},\\
|
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\textit{J. Chem. Phys.}, \textbf{2022}, \textit{157}, 014103.
|
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|
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\item
|
||||
\href{https://www.irsamc.ups-tlse.fr/loos/pub/115.pdf}{Reference energies for cyclobutadiene: automerization and excited states},\\
|
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\href{https://pfloos.github.io/WEB_LOOS/pub/115.pdf}{Reference energies for cyclobutadiene: automerization and excited states},\\
|
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E. Monino*, M. Boggio-Pasqua, A. Scemama, D. Jacquemin, and \textbf{P. F. Loos*},\\
|
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\textit{J. Phys. Chem. A}, \textbf{2022}, \textit{126}, 4664.
|
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|
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\item
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\href{https://www.irsamc.ups-tlse.fr/loos/pub/114.pdf}{Hierarchy configuration interaction: combining seniority number and excitation degree},\\
|
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\href{https://pfloos.github.io/WEB_LOOS/pub/114.pdf}{Hierarchy configuration interaction: combining seniority number and excitation degree},\\
|
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F. Kossoski*, Y. Damour, and \textbf{P. F. Loos*},\\
|
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\textit{J. Phys. Chem. Lett.}, \textbf{2022}, \textit{13}, 4342.
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|
@ -144,92 +192,92 @@
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\textit{Mol. Phys.}, \textbf{2022}, \textit{} (in press).
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|
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\item
|
||||
\href{https://www.irsamc.ups-tlse.fr/loos/pub/112.pdf}{Unphysical discontinuities, intruder states and regularization in $GW$ methods},\\
|
||||
\href{https://pfloos.github.io/WEB_LOOS/pub/112.pdf}{Unphysical discontinuities, intruder states and regularization in $GW$ methods},\\
|
||||
E. Monino and \textbf{P. F. Loos*},\\
|
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\textit{J. Chem. Phys.}, \textbf{2022}, \textit{156}, 231101.
|
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|
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\item
|
||||
\href{https://www.irsamc.ups-tlse.fr/loos/pub/111.pdf}{Static and dynamic Bethe-Salpeter equations in the $T$-matrix approximation},\\
|
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\href{https://pfloos.github.io/WEB_LOOS/pub/111.pdf}{Static and dynamic Bethe-Salpeter equations in the $T$-matrix approximation},\\
|
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\textbf{P. F. Loos*} and P. Romaniello*,\\
|
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\textit{J. Chem. Phys.}, \textbf{2022}, \textit{156}, 164101.
|
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|
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\item
|
||||
\href{https://www.irsamc.ups-tlse.fr/loos/pub/110.pdf}{Assessing the performances of CASPT2 and NEVPT2 for vertical excitation energies},\\
|
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\href{https://pfloos.github.io/WEB_LOOS/pub/110.pdf}{Assessing the performances of CASPT2 and NEVPT2 for vertical excitation energies},\\
|
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R. Sarka, \textbf{P. F. Loos} , M. Boggio-Pasqua*, and D. Jacquemin*,\\
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\textit{J. Chem. Theory Comput.}, \textbf{2022}, \textit{18}, 2418.
|
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|
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\item
|
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\href{https://www.irsamc.ups-tlse.fr/loos/pub/109.pdf}{A mountaineering strategy to excited states: highly-accurate energies and benchmarks for bicyclic systems},\\
|
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\href{https://pfloos.github.io/WEB_LOOS/pub/109.pdf}{A mountaineering strategy to excited states: highly-accurate energies and benchmarks for bicyclic systems},\\
|
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\textbf{P. F. Loos*} and D. Jacquemin*,\\
|
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\textit{J. Phys. Chem. A}, \textbf{2021}, \textit{125}, 10174.
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\item
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\href{https://www.irsamc.ups-tlse.fr/loos/pub/108.pdf}{Accurate full configuration interaction correlation energy estimates for five- and six-membered rings},\\
|
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\href{https://pfloos.github.io/WEB_LOOS/pub/108.pdf}{Accurate full configuration interaction correlation energy estimates for five- and six-membered rings},\\
|
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Y. Damour, M. V\'eril, F. Kossoski, M. Caffarel, D. Jacquemin*, A. Scemama*, and \textbf{P. F. Loos*},\\
|
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\textit{J. Chem. Phys.}, \textbf{2021}, \textit{155}, 134104.
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|
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\item
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||||
\href{https://www.irsamc.ups-tlse.fr/loos/pub/107.pdf}{Scrutinizing GW-based methods using the Hubbard dimer},\\
|
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\href{https://pfloos.github.io/WEB_LOOS/pub/107.pdf}{Scrutinizing GW-based methods using the Hubbard dimer},\\
|
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S. Di Sabatino*, \textbf{P. F. Loos}, and P. Romaniello,\\
|
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\textit{Front. Chem.}, \textbf{2021}, \textit{9}, 751054.
|
||||
|
||||
\item
|
||||
\href{https://www.irsamc.ups-tlse.fr/loos/pub/106.pdf}{Variational coupled cluster for ground and excited states},\\
|
||||
\href{https://pfloos.github.io/WEB_LOOS/pub/106.pdf}{Variational coupled cluster for ground and excited states},\\
|
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A. Marie, F. Kossoski, and \textbf{P. F. Loos*},\\
|
||||
\textit{J. Chem. Phys.}, \textbf{2021}, \textit{155}, 104105.
|
||||
|
||||
\item
|
||||
\href{https://www.irsamc.ups-tlse.fr/loos/pub/105.pdf}{Variations of the Hartree-Fock fractional-spin error for one electron},\\
|
||||
\href{https://pfloos.github.io/WEB_LOOS/pub/105.pdf}{Variations of the Hartree-Fock fractional-spin error for one electron},\\
|
||||
H. G. A. Burton*, C. Marut, T. J. Daas, P. Gori-Giorgi, and \textbf{P. F. Loos*},\\
|
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\textit{J. Chem. Phys.}, \textbf{2021}, \textit{155}, 054107.
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|
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\item
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||||
\href{https://www.irsamc.ups-tlse.fr/loos/pub/104.pdf}{How accurate are EOM-CC4 vertical excitation energies?},\\
|
||||
\href{https://pfloos.github.io/WEB_LOOS/pub/104.pdf}{How accurate are EOM-CC4 vertical excitation energies?},\\
|
||||
\textbf{P. F. Loos*}, D. A. Matthews, F. Lipparini, and D. Jacquemin*,\\
|
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\textit{J. Chem. Phys.}, \textbf{2021}, \textit{154}, 221103.
|
||||
|
||||
\item
|
||||
\href{https://www.irsamc.ups-tlse.fr/loos/pub/103.pdf}{Excited states from state-specific orbital-optimized pair coupled-cluster},\\
|
||||
\href{https://pfloos.github.io/WEB_LOOS/pub/103.pdf}{Excited states from state-specific orbital-optimized pair coupled-cluster},\\
|
||||
F. Kossoski*, A. Marie, A. Scemama, M. Caffarel, and \textbf{P. F. Loos*},\\
|
||||
\textit{J. Chem. Theory Comput.}, \textbf{2021}, \textit{17}, 4756.
|
||||
|
||||
\item
|
||||
\href{https://www.irsamc.ups-tlse.fr/loos/pub/102.pdf}{Reference energies for intramolecular charge-transfer excitations},\\
|
||||
\href{https://pfloos.github.io/WEB_LOOS/pub/102.pdf}{Reference energies for intramolecular charge-transfer excitations},\\
|
||||
\textbf{P. F. Loos*}, M. Comin, X. Blase*, and D. Jacquemin*,\\
|
||||
\textit{J. Chem. Theory Comput.}, \textbf{2021}, \textit{17}, 3666.
|
||||
|
||||
\item
|
||||
(Book chapter) \href{https://www.irsamc.ups-tlse.fr/loos/pub/101.pdf}{Spin-adapted selected configuration interaction in a determinant basis},\\
|
||||
(Book chapter) \href{https://pfloos.github.io/WEB_LOOS/pub/101.pdf}{Spin-adapted selected configuration interaction in a determinant basis},\\
|
||||
V. G. Chilkuri, T. Applencourt, K. Gasperich, \textbf{P. F. Loos}, and A. Scemama*,\\
|
||||
\textit{Adv. Quantum Chem.}, \textbf{2021}, \textit{83}, 65.
|
||||
|
||||
\item
|
||||
\href{https://www.irsamc.ups-tlse.fr/loos/pub/100.pdf}{Spin-conserved and spin-flip optical excitations from the Bethe-Salpeter equation formalism},\\
|
||||
\href{https://pfloos.github.io/WEB_LOOS/pub/100.pdf}{Spin-conserved and spin-flip optical excitations from the Bethe-Salpeter equation formalism},\\
|
||||
E. Monino and \textbf{P. F. Loos*},\\
|
||||
\textit{J. Chem. Theory Comput.}, \textbf{2021}, \textit{17}, 2852.
|
||||
|
||||
\item
|
||||
\href{https://www.irsamc.ups-tlse.fr/loos/pub/99.pdf}{Perturbation theory in the complex plane: exceptional points and where to find them},\\
|
||||
\href{https://pfloos.github.io/WEB_LOOS/pub/99.pdf}{Perturbation theory in the complex plane: exceptional points and where to find them},\\
|
||||
A. Marie, H. G. A. Burton*, and \textbf{P. F. Loos*},\\
|
||||
\textit{J. Phys. Cond. Mat.}, \textbf{2021}, \textit{33}, 283001.
|
||||
|
||||
\item
|
||||
\href{https://www.irsamc.ups-tlse.fr/loos/pub/98.pdf}{QUESTDB: a database of highly-accurate excitation energies for the electronic structure community},\\
|
||||
\href{https://pfloos.github.io/WEB_LOOS/pub/98.pdf}{QUESTDB: a database of highly-accurate excitation energies for the electronic structure community},\\
|
||||
M. V\'eril, A. Scemama, M. Caffarel, F. Lipparini, M. Boggio-Pasqua, D. Jacquemin*, and \textbf{P. F. Loos*},\\
|
||||
\textit{WIREs Comput. Mol. Sci.}, \textbf{2021}, \textit{11} e1517.
|
||||
|
||||
\item
|
||||
\href{https://www.irsamc.ups-tlse.fr/loos/pub/97.pdf}{Benchmarking TD-DFT and wave function methods for oscillator strengths and excited-state dipole moments},\\
|
||||
\href{https://pfloos.github.io/WEB_LOOS/pub/97.pdf}{Benchmarking TD-DFT and wave function methods for oscillator strengths and excited-state dipole moments},\\
|
||||
R. Sarkar, M. Boggio-Pasqua, \textbf{P. F. Loos*}, and D. Jacquemin*,\\
|
||||
\textit{J. Chem. Theory Comput.}, \textbf{2021}, \textit{17}, 1106.
|
||||
|
||||
\item
|
||||
\href{https://www.irsamc.ups-tlse.fr/loos/pub/96.pdf}{Potential energy surfaces without unphysical discontinuities: the Coulomb-hole plus screened exchange approach},\\
|
||||
\href{https://pfloos.github.io/WEB_LOOS/pub/96.pdf}{Potential energy surfaces without unphysical discontinuities: the Coulomb-hole plus screened exchange approach},\\
|
||||
J. A. Berger*, \textbf{P. F. Loos}, and P. Romaniello,\\
|
||||
\textit{J. Chem. Theory Comput.}, \textbf{2021}, \textit{17}, 191.
|
||||
|
||||
\item
|
||||
\href{https://www.irsamc.ups-tlse.fr/loos/pub/95.pdf}{A mountaineering strategy to excited states: highly-accurate oscillator strengths and dipole moments of small molecules},\\
|
||||
\href{https://pfloos.github.io/WEB_LOOS/pub/95.pdf}{A mountaineering strategy to excited states: highly-accurate oscillator strengths and dipole moments of small molecules},\\
|
||||
A. Chrayteh, A. Blondel, \textbf{P. F. Loos}, and D. Jacquemin*,\\
|
||||
\textit{J. Chem. Theory Comput.}, \textbf{2021}, \textit{17}, 416.
|
||||
|
||||
|
|
|
|||
Loading…
Reference in New Issue