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The Journal of Chemical Physics
|
May 2, 2016
Combining the GW formalism with the polarizable continuum model: A state-specific non-equilibrium approach
Ivan Duchemin, Denis Jacquemin, Xavier Blase
Journal of Chemical Theory and Computation
|
September 3, 2024
Polarizable Continuum Models and Green's Function <i>GW</i> Formalism: On the Dynamics of the Solvent Electrons
Ivan Duchemin, David Amblard, Xavier Blase
Journal of Chemical Theory and Computation
|
November 18, 2015
0-0 Energies Using Hybrid Schemes: Benchmarks of TD-DFT, CIS(D), ADC(2), CC2, and BSE/GW formalisms for 80 Real-Life Compounds
Denis Jacquemin, Ivan Duchemin, Xavier Blase
The Journal of Chemical Physics
|
October 24, 2023
Many-body GW calculations with very large scale polarizable environments made affordable: A fully ab initio QM/QM approach
David Amblard, Xavier Blase, Ivan Duchemin
The Journal of Physical Chemistry Letters
|
March 17, 2017
Is the Bethe-Salpeter Formalism Accurate for Excitation Energies? Comparisons with TD-DFT, CASPT2, and EOM-CCSD
Denis Jacquemin, Ivan Duchemin, Xavier Blase
Journal of Chemical Theory and Computation
|
January 18, 2017
Hybrid and Constrained Resolution-of-Identity Techniques for Coulomb Integrals
Ivan Duchemin, Jing Li, Xavier Blase
The Journal of Physical Chemistry Letters
|
February 10, 2017
Modeling the Photochrome-TiO<sub>2</sub> Interface with Bethe-Salpeter and Time-Dependent Density Functional Theory Methods
Daniel Escudero, Ivan Duchemin, Xavier Blase, et al.
Journal of Chemical Theory and Computation
|
November 19, 2015
Fast and Accurate Electronic Excitations in Cyanines with the Many-Body Bethe-Salpeter Approach
Paul Boulanger, Denis Jacquemin, Ivan Duchemin, et al.
Journal of Chemical Theory and Computation
|
January 21, 2017
Benchmark of Bethe-Salpeter for Triplet Excited-States
Denis Jacquemin, Ivan Duchemin, Aymeric Blondel, et al.
Journal of Chemical Theory and Computation
|
July 13, 2016
Assessment of the Accuracy of the Bethe-Salpeter (BSE/GW) Oscillator Strengths
Denis Jacquemin, Ivan Duchemin, Aymeric Blondel, et al.
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of 5
Search research articles
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Showing results (11-20 of 44) with videos related to
Sort By:
Page
of 5
The Journal of Chemical Physics
|
May 2, 2016
Combining the GW formalism with the polarizable continuum model: A state-specific non-equilibrium approach
Ivan Duchemin, Denis Jacquemin, Xavier Blase
Journal of Chemical Theory and Computation
|
September 3, 2024
Polarizable Continuum Models and Green's Function <i>GW</i> Formalism: On the Dynamics of the Solvent Electrons
Ivan Duchemin, David Amblard, Xavier Blase
Journal of Chemical Theory and Computation
|
November 18, 2015
0-0 Energies Using Hybrid Schemes: Benchmarks of TD-DFT, CIS(D), ADC(2), CC2, and BSE/GW formalisms for 80 Real-Life Compounds
Denis Jacquemin, Ivan Duchemin, Xavier Blase
The Journal of Chemical Physics
|
October 24, 2023
Many-body GW calculations with very large scale polarizable environments made affordable: A fully ab initio QM/QM approach
David Amblard, Xavier Blase, Ivan Duchemin
The Journal of Physical Chemistry Letters
|
March 17, 2017
Is the Bethe-Salpeter Formalism Accurate for Excitation Energies? Comparisons with TD-DFT, CASPT2, and EOM-CCSD
Denis Jacquemin, Ivan Duchemin, Xavier Blase
Journal of Chemical Theory and Computation
|
January 18, 2017
Hybrid and Constrained Resolution-of-Identity Techniques for Coulomb Integrals
Ivan Duchemin, Jing Li, Xavier Blase
The Journal of Physical Chemistry Letters
|
February 10, 2017
Modeling the Photochrome-TiO<sub>2</sub> Interface with Bethe-Salpeter and Time-Dependent Density Functional Theory Methods
Daniel Escudero, Ivan Duchemin, Xavier Blase, et al.
Journal of Chemical Theory and Computation
|
November 19, 2015
Fast and Accurate Electronic Excitations in Cyanines with the Many-Body Bethe-Salpeter Approach
Paul Boulanger, Denis Jacquemin, Ivan Duchemin, et al.
Journal of Chemical Theory and Computation
|
January 21, 2017
Benchmark of Bethe-Salpeter for Triplet Excited-States
Denis Jacquemin, Ivan Duchemin, Aymeric Blondel, et al.
Journal of Chemical Theory and Computation
|
July 13, 2016
Assessment of the Accuracy of the Bethe-Salpeter (BSE/GW) Oscillator Strengths
Denis Jacquemin, Ivan Duchemin, Aymeric Blondel, et al.
Page
of 5