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Dmitrii V Shalashilin

Showing results (1-10 of 42) with videos related to

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The Journal of Chemical Physics|July 2, 2010
Nonadiabatic dynamics with the help of multiconfigurational Ehrenfest method: Improved theory and fully quantum 24D simulation of pyrazineDmitrii V Shalashilin
The Journal of Chemical Physics|July 2, 2009
Quantum mechanics with the basis set guided by Ehrenfest trajectories: theory and application to spin-boson modelDmitrii V Shalashilin
The Journal of Chemical Physics|October 12, 2018
Zombie states for description of structure and dynamics of multi-electron systemsDmitrii V Shalashilin
Faraday Discussions|March 29, 2012
Multiconfigurational Ehrenfest approach to quantum coherent dynamics in large molecular systemsDmitrii V Shalashilin
The Journal of Chemical Physics|December 3, 2008
Gaussian-based techniques for quantum propagation from the time-dependent variational principle: Formulation in terms of trajectories of coupled classical and quantum variablesDmitrii V Shalashilin, Irene Burghardt
The Journal of Physical Chemistry. A|April 17, 2013
Numerical implementation and test of the modified variational multiconfigurational Gaussian method for high-dimensional quantum dynamicsMiklos Ronto, Dmitrii V Shalashilin
The Journal of Chemical Physics|December 20, 2012
On-the-fly ab initio molecular dynamics with multiconfigurational Ehrenfest methodKenichiro Saita, Dmitrii V Shalashilin
The Journal of Physical Chemistry. B|January 14, 2016
Fully Atomistic Simulations of Protein Unfolding in Low Speed Atomic Force Microscope and Force Clamp Experiments with the Help of Boxed Molecular DynamicsJonathan J Booth, Dmitrii V Shalashilin
The Journal of Chemical Physics|October 2, 2025
A new form of particle number conserving fermionic coherent states for electronic structure theory and electron dynamicsDmitrii V Shalashilin, Dmitry V Makhov
The Journal of Chemical Physics|August 12, 2004
Real time quantum propagation on a Monte Carlo trajectory guided grids of coupled coherent states: 26D simulation of pyrazine absorption spectrumDmitrii V Shalashilin, Mark S Child
Pageof 5

Showing results (1-10 of 42) with videos related to

Sort By:
Pageof 5
The Journal of Chemical Physics|July 2, 2010
Nonadiabatic dynamics with the help of multiconfigurational Ehrenfest method: Improved theory and fully quantum 24D simulation of pyrazineDmitrii V Shalashilin
The Journal of Chemical Physics|July 2, 2009
Quantum mechanics with the basis set guided by Ehrenfest trajectories: theory and application to spin-boson modelDmitrii V Shalashilin
The Journal of Chemical Physics|October 12, 2018
Zombie states for description of structure and dynamics of multi-electron systemsDmitrii V Shalashilin
Faraday Discussions|March 29, 2012
Multiconfigurational Ehrenfest approach to quantum coherent dynamics in large molecular systemsDmitrii V Shalashilin
The Journal of Chemical Physics|December 3, 2008
Gaussian-based techniques for quantum propagation from the time-dependent variational principle: Formulation in terms of trajectories of coupled classical and quantum variablesDmitrii V Shalashilin, Irene Burghardt
The Journal of Physical Chemistry. A|April 17, 2013
Numerical implementation and test of the modified variational multiconfigurational Gaussian method for high-dimensional quantum dynamicsMiklos Ronto, Dmitrii V Shalashilin
The Journal of Chemical Physics|December 20, 2012
On-the-fly ab initio molecular dynamics with multiconfigurational Ehrenfest methodKenichiro Saita, Dmitrii V Shalashilin
The Journal of Physical Chemistry. B|January 14, 2016
Fully Atomistic Simulations of Protein Unfolding in Low Speed Atomic Force Microscope and Force Clamp Experiments with the Help of Boxed Molecular DynamicsJonathan J Booth, Dmitrii V Shalashilin
The Journal of Chemical Physics|October 2, 2025
A new form of particle number conserving fermionic coherent states for electronic structure theory and electron dynamicsDmitrii V Shalashilin, Dmitry V Makhov
The Journal of Chemical Physics|August 12, 2004
Real time quantum propagation on a Monte Carlo trajectory guided grids of coupled coherent states: 26D simulation of pyrazine absorption spectrumDmitrii V Shalashilin, Mark S Child
Pageof 5