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The Journal of Physical Chemistry. A|September 7, 2022
A Semiclassical Framework for Mixed Quantum Classical DynamicsShreyas Malpathak, Matthew S Church, Nandini Ananth
The Journal of Chemical Physics|September 5, 2024
Semiclassical dynamics in Wigner phase space I: Adiabatic hybrid Wigner dynamicsShreyas Malpathak, Nandini Ananth
The Journal of Physical Chemistry Letters|January 17, 2024
A Linearized Semiclassical Dynamics Study of the Multiquantum Vibrational Relaxation of NO Scattering from a Au(111) SurfaceShreyas Malpathak, Nandini Ananth
The Journal of Chemical Physics|March 15, 2023
Non-linear correlation functions and zero-point energy flow in mixed quantum-classical semiclassical dynamicsShreyas Malpathak, Nandini Ananth
The Journal of Chemical Physics|September 5, 2024
Semiclassical dynamics in Wigner phase space II: Nonadiabatic hybrid Wigner dynamicsShreyas Malpathak, Nandini Ananth
The Journal of Chemical Physics|October 10, 2019
Semiclassical dynamics in the mixed quantum-classical limitMatthew S Church, Nandini Ananth
The Journal of Chemical Physics|June 24, 2017
Validating and implementing modified Filinov phase filtration in semiclassical dynamicsMatthew S Church, Sergey V Antipov, Nandini Ananth
The Journal of Chemical Physics|March 17, 2018
Nonadiabatic semiclassical dynamics in the mixed quantum-classical initial value representationMatthew S Church, Timothy J H Hele, Gregory S Ezra, et al.
The Journal of Physical Chemistry. A|February 23, 2019
Unimolecular Rate Constants versus Energy and Pressure as a Convolution of Unimolecular Lifetime and Collisional Deactivation Probabilities. Analyses of Intrinsic Non-RRKM DynamicsShreyas Malpathak, William L Hase
The Journal of Chemical Physics|May 3, 2018
Direct dynamics simulations of the unimolecular dissociation of dioxetane: Probing the non-RRKM dynamicsShreyas Malpathak, Xinyou Ma, William L Hase
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