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Emmanuel Fromager

Showing results (11-20 of 31) with videos related to

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The Journal of Chemical Physics|July 27, 2011
Analysis of self-consistency effects in range-separated density-functional theory with Møller-Plesset perturbation theoryEmmanuel Fromager, Hans Jørgen Aa Jensen
Journal of Chemical Theory and Computation|October 17, 2025
Local Potential Functional Embedding Theory of Molecular Systems: Localized Orbital-Based Embedding from an Exact Density-Functional PerspectiveWafa Makhlouf, Bruno Senjean, Emmanuel Fromager
The Journal of Chemical Physics|March 3, 2007
On the universality of the long-/short-range separation in multiconfigurational density-functional theoryEmmanuel Fromager, Julien Toulouse, Hans Jorgen Aa Jensen
Topics in Current Chemistry (Cham)|November 26, 2021
Ensemble Density Functional Theory of Neutral and Charged Excitations : Exact Formulations, Standard Approximations, and Open QuestionsFilip Cernatic, Bruno Senjean, Vincent Robert, et al.
The Journal of Chemical Physics|March 8, 2013
Multi-configuration time-dependent density-functional theory based on range separationEmmanuel Fromager, Stefan Knecht, Hans Jørgen Aa Jensen
The Journal of Chemical Physics|November 5, 2005
On the accuracy of one-component pseudopotential spin-orbit calculationsEmmanuel Fromager, Lucas Visscher, Laurent Maron, et al.
The Journal of Chemical Physics|February 17, 2017
Electron transport through a spin crossover junction. Perspectives from a wavefunction-based approachSergi Vela, Martin Verot, Emmanuel Fromager, et al.
The Journal of Chemical Physics|December 13, 2022
Quantum embedding of multi-orbital fragments using the block-Householder transformationSaad Yalouz, Sajanthan Sekaran, Emmanuel Fromager, et al.
The Journal of Chemical Physics|December 3, 2017
Combining extrapolation with ghost interaction correction in range-separated ensemble density functional theory for excited statesMd Mehboob Alam, Killian Deur, Stefan Knecht, et al.
Faraday Discussions|September 10, 2020
Weight dependence of local exchange-correlation functionals in ensemble density-functional theory: double excitations in two-electron systemsClotilde Marut, Bruno Senjean, Emmanuel Fromager, et al.
Pageof 4

Showing results (11-20 of 31) with videos related to

Sort By:
Pageof 4
The Journal of Chemical Physics|July 27, 2011
Analysis of self-consistency effects in range-separated density-functional theory with Møller-Plesset perturbation theoryEmmanuel Fromager, Hans Jørgen Aa Jensen
Journal of Chemical Theory and Computation|October 17, 2025
Local Potential Functional Embedding Theory of Molecular Systems: Localized Orbital-Based Embedding from an Exact Density-Functional PerspectiveWafa Makhlouf, Bruno Senjean, Emmanuel Fromager
The Journal of Chemical Physics|March 3, 2007
On the universality of the long-/short-range separation in multiconfigurational density-functional theoryEmmanuel Fromager, Julien Toulouse, Hans Jorgen Aa Jensen
Topics in Current Chemistry (Cham)|November 26, 2021
Ensemble Density Functional Theory of Neutral and Charged Excitations : Exact Formulations, Standard Approximations, and Open QuestionsFilip Cernatic, Bruno Senjean, Vincent Robert, et al.
The Journal of Chemical Physics|March 8, 2013
Multi-configuration time-dependent density-functional theory based on range separationEmmanuel Fromager, Stefan Knecht, Hans Jørgen Aa Jensen
The Journal of Chemical Physics|November 5, 2005
On the accuracy of one-component pseudopotential spin-orbit calculationsEmmanuel Fromager, Lucas Visscher, Laurent Maron, et al.
The Journal of Chemical Physics|February 17, 2017
Electron transport through a spin crossover junction. Perspectives from a wavefunction-based approachSergi Vela, Martin Verot, Emmanuel Fromager, et al.
The Journal of Chemical Physics|December 13, 2022
Quantum embedding of multi-orbital fragments using the block-Householder transformationSaad Yalouz, Sajanthan Sekaran, Emmanuel Fromager, et al.
The Journal of Chemical Physics|December 3, 2017
Combining extrapolation with ghost interaction correction in range-separated ensemble density functional theory for excited statesMd Mehboob Alam, Killian Deur, Stefan Knecht, et al.
Faraday Discussions|September 10, 2020
Weight dependence of local exchange-correlation functionals in ensemble density-functional theory: double excitations in two-electron systemsClotilde Marut, Bruno Senjean, Emmanuel Fromager, et al.
Pageof 4