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The Journal of Physical Chemistry. B|January 17, 2014
Excited-state deactivation pathways in uracil versus hydrated uracil: solvatochromatic shift in the (1)nπ* state is the keyXing Zhang, John M Herbert
The Journal of Chemical Physics|February 16, 2015
Analytic derivative couplings in time-dependent density functional theory: Quadratic response theory versus pseudo-wavefunction approachXing Zhang, John M Herbert
The Journal of Chemical Physics|December 24, 2015
Spin-flip, tensor equation-of-motion configuration interaction with a density-functional correction: A spin-complete method for exploring excited-state potential energy surfacesXing Zhang, John M Herbert
The Journal of Chemical Physics|October 2, 2021
Nonadiabatic dynamics with spin-flip vs linear-response time-dependent density functional theory: A case study for the protonated Schiff base C<sub>5</sub>H<sub>6</sub>NH<sub>2</sub><sup></sup>Xing Zhang, John M Herbert
The Journal of Chemical Physics|August 20, 2014
Analytic derivative couplings for spin-flip configuration interaction singles and spin-flip time-dependent density functional theoryXing Zhang, John M Herbert
Accounts of Chemical Research|April 22, 2016
Beyond Time-Dependent Density Functional Theory Using Only Single Excitations: Methods for Computational Studies of Excited States in Complex SystemsJohn M Herbert, Xing Zhang, Adrian F Morrison, et al.
Physical Chemistry Chemical Physics : PCCP|January 16, 2024
Visualizing and characterizing excited states from time-dependent density functional theoryJohn M Herbert
Physical Chemistry Chemical Physics : PCCP|August 23, 2024
Correction: Visualizing and characterizing excited states from time-dependent density functional theoryJohn M Herbert
The Journal of Chemical Physics|November 10, 2019
Fantasy versus reality in fragment-based quantum chemistryJohn M Herbert
The Journal of Physical Chemistry. A|August 13, 2021
Neat, Simple, and Wrong: Debunking Electrostatic Fallacies Regarding Noncovalent InteractionsJohn M Herbert
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