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Journal of the American Chemical Society|June 26, 2003
Quantum dynamics simulations of interfacial electron transfer in sensitized TiO2 semiconductorsLuis G C Rego, Victor S Batista
Journal of Chemical Theory and Computation|February 14, 2025
Simulating Non-Markovian Quantum Dynamics on NISQ Computers Using the Hierarchical Equations of MotionXiaohan Dan, Eitan Geva, Victor S Batista
The Journal of Physical Chemistry. A|February 5, 2016
Time-Sliced Thawed Gaussian Propagation Method for Simulations of Quantum DynamicsXiangmeng Kong, Andreas Markmann, Victor S Batista
Journal of Chemical Theory and Computation|November 24, 2015
Kepler Predictor-Corrector Algorithm: Scattering Dynamics with One-Over-R Singular PotentialsAndreas Markmann, Frank Graziani, Victor S Batista
Journal of Chemical Theory and Computation|July 8, 2010
Characterization of proton coupled electron transfer in a biomimetic oxomanganese complex: Evaluation of the DFT B3LYP level of theoryTing Wang, Gary Brudvig, Victor S Batista
Journal of the American Chemical Society|June 20, 2013
Spectral tuning in halorhodopsin: the chloride pump photoreceptorRhitankar Pal, Sivakumar Sekharan, Victor S Batista
The Journal of Chemical Physics|March 3, 2005
Matching-pursuit/split-operator-Fourier-transform computations of thermal correlation functionsXin Chen, Yinghua Wu, Victor S Batista
Frontiers in Molecular Biosciences|November 17, 2022
Translocation pause of remdesivir-containing primer/template RNA duplex within SARS-CoV-2's RNA polymerase complexesYuanjun Shi, Jimin Wang, Victor S Batista
The Journal of Chemical Physics|April 20, 2005
Is the Filinov integral conditioning technique useful in semiclassical initial value representation methods?Michael Spanner, Victor S Batista, Paul Brumer
Journal of Chemical Theory and Computation|January 4, 2018
Can TDDFT Describe Excited Electronic States of Naphthol Photoacids? A Closer Look with EOM-CCSDAtanu Acharya, Subhajyoti Chaudhuri, Victor S Batista
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