Showing results (21-30 of 128) with videos related to
Sort By:
Pageof 13
The Journal of Physical Chemistry Letters|July 15, 2021
Investigating Tunneling-Controlled Chemical Reactions through Ab Initio Ring Polymer Molecular DynamicsXinyang Li, Pengfei HuoJournal of Chemical Theory and Computation|March 31, 2023
Ab Initio Molecular Cavity Quantum Electrodynamics Simulations Using Machine Learning ModelsDeping Hu, Pengfei HuoThe Journal of Chemical Physics|August 22, 2023
Resonance theory and quantum dynamics simulations of vibrational polariton chemistryWenxiang Ying, Pengfei HuoACS Applied Materials & Interfaces|February 7, 2023
In Silico High-Throughput Design and Prediction of Structural and Electronic Properties of Low-Dimensional Metal-Organic FrameworksZeyu Zhang, Dylan S Valente, Yuliang Shi, et al.The Journal of Chemical Physics|July 1, 2019
State dependent ring polymer molecular dynamics for investigating excited nonadiabatic dynamicsSutirtha N Chowdhury, Pengfei HuoThe Journal of Chemical Physics|December 10, 2017
Coherent state mapping ring polymer molecular dynamics for non-adiabatic quantum propagationsSutirtha N Chowdhury, Pengfei HuoThe Journal of Chemical Physics|December 20, 2012
Consistent schemes for non-adiabatic dynamics derived from partial linearized density matrix propagationPengfei Huo, David F CokerPhysical Chemistry Chemical Physics : PCCP|June 16, 2015
Electronic coherence and the kinetics of inter-complex energy transfer in light-harvesting systemsPengfei Huo, Thomas F MillerThe Journal of Physical Chemistry Letters|May 19, 2017
Enhancing Singlet Fission Dynamics by Suppressing Destructive Interference between Charge-Transfer PathwaysMaria A Castellanos, Pengfei HuoThe Journal of Chemical Physics|April 3, 2021
Non-adiabatic Matsubara dynamics and non-adiabatic ring-polymer molecular dynamicsSutirtha N Chowdhury, Pengfei HuoPageof 13