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The Journal of Chemical Physics
|
July 26, 2006
On correlated electron-nuclear dynamics using time-dependent density functional theory
Neepa T Maitra
Annual Review of Physical Chemistry
|
December 15, 2021
Double and Charge-Transfer Excitations in Time-Dependent Density Functional Theory
Neepa T Maitra
The Journal of Chemical Physics
|
July 13, 2005
Undoing static correlation: long-range charge transfer in time-dependent density-functional theory
Neepa T Maitra
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
August 3, 2017
Charge transfer in time-dependent density functional theory
Neepa T Maitra
The Journal of Chemical Physics
|
June 17, 2016
Perspective: Fundamental aspects of time-dependent density functional theory
Neepa T Maitra
Journal of Chemical Theory and Computation
|
January 29, 2019
Density-Matrix Coupled Time-Dependent Exchange-Correlation Functional Approximations
Lionel Lacombe, Neepa T Maitra
The Journal of Chemical Physics
|
September 22, 2011
Electron correlation via frozen Gaussian dynamics
Peter Elliott, Neepa T Maitra
The Journal of Physical Chemistry Letters
|
August 31, 2021
Minimizing the Time-Dependent Density Functional Error in Ehrenfest Dynamics
Lionel Lacombe, Neepa T Maitra
Faraday Discussions
|
September 14, 2020
Developing new and understanding old approximations in TDDFT
Lionel Lacombe, Neepa T Maitra
The Journal of Chemical Physics
|
October 1, 2024
Exciting DeePMD: Learning excited-state energies, forces, and non-adiabatic couplings
Lucien Dupuy, Neepa T Maitra
Page
of 6
Search research articles
Search
Showing results (1-10 of 60) with videos related to
Sort By:
Page
of 6
The Journal of Chemical Physics
|
July 26, 2006
On correlated electron-nuclear dynamics using time-dependent density functional theory
Neepa T Maitra
Annual Review of Physical Chemistry
|
December 15, 2021
Double and Charge-Transfer Excitations in Time-Dependent Density Functional Theory
Neepa T Maitra
The Journal of Chemical Physics
|
July 13, 2005
Undoing static correlation: long-range charge transfer in time-dependent density-functional theory
Neepa T Maitra
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
August 3, 2017
Charge transfer in time-dependent density functional theory
Neepa T Maitra
The Journal of Chemical Physics
|
June 17, 2016
Perspective: Fundamental aspects of time-dependent density functional theory
Neepa T Maitra
Journal of Chemical Theory and Computation
|
January 29, 2019
Density-Matrix Coupled Time-Dependent Exchange-Correlation Functional Approximations
Lionel Lacombe, Neepa T Maitra
The Journal of Chemical Physics
|
September 22, 2011
Electron correlation via frozen Gaussian dynamics
Peter Elliott, Neepa T Maitra
The Journal of Physical Chemistry Letters
|
August 31, 2021
Minimizing the Time-Dependent Density Functional Error in Ehrenfest Dynamics
Lionel Lacombe, Neepa T Maitra
Faraday Discussions
|
September 14, 2020
Developing new and understanding old approximations in TDDFT
Lionel Lacombe, Neepa T Maitra
The Journal of Chemical Physics
|
October 1, 2024
Exciting DeePMD: Learning excited-state energies, forces, and non-adiabatic couplings
Lucien Dupuy, Neepa T Maitra
Page
of 6