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The Journal of Physical Chemistry. A|July 25, 2017
Calculations of n→π* Transition Energies: Comparisons Between TD-DFT, ADC, CC, CASPT2, and BSE/GW DescriptionsCloé Azarias, Chloé Habert, Šimon Budzák, et al.Physical Chemistry Chemical Physics : PCCP|October 31, 2023
Excess and excited-state dipole moments of real-life dyes: a comparison between wave-function, BSE/<i>GW</i>, and TD-DFT valuesIryna Knysh, Jose D J Villalobos-Castro, Ivan Duchemin, et al.Journal of Chemical Theory and Computation|November 21, 2015
Combining the Bethe-Salpeter Formalism with Time-Dependent DFT Excited-State Forces to Describe Optical Signatures: NBO Fluoroborates as Working ExamplesPaul Boulanger, Siwar Chibani, Boris Le Guennic, et al.The Journal of Physical Chemistry Letters|April 12, 2023
Exploring Bethe-Salpeter Excited-State Dipoles: The Challenging Case of Increasingly Long Push-Pull OligomersIryna Knysh, Jose D J Villalobos-Castro, Ivan Duchemin, et al.Journal of Chemical Theory and Computation|November 21, 2015
Benchmark Many-Body GW and Bethe-Salpeter Calculations for Small Transition Metal MoleculesSabine Körbel, Paul Boulanger, Ivan Duchemin, et al.Journal of Chemical Theory and Computation|September 5, 2024
Reference CC3 Excitation Energies for Organic Chromophores: Benchmarking TD-DFT, BSE/<i>GW</i>, and Wave Function MethodsIryna Knysh, Filippo Lipparini, Aymeric Blondel, et al.Journal of Chemical Theory and Computation|November 22, 2015
Efficient Computation of Hartree-Fock Exchange Using Recursive Subspace BisectionFrançois Gygi, Ivan DucheminThe Journal of Chemical Physics|August 23, 2023
Computing photoionization spectra in Gaussian basis setsIvan Duchemin, Antoine LevittThe Journal of Chemical Physics|September 23, 2020
Dynamical correction to the Bethe-Salpeter equation beyond the plasmon-pole approximationPierre-François Loos, Xavier BlaseAdvanced Materials (Deerfield Beach, Fla.)|October 14, 2021
Doping-Induced Dielectric Catastrophe Prompts Free-Carrier Release in Organic SemiconductorsMassimiliano Comin, Simone Fratini, Xavier Blase, et al.Pageof 6