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William James Glover
William James Glover
Assistant Prof. of Chemistry, NYU Shanghai; Associate Director, NYU-ECNU Center for Comp. Chem.
Dirección de correo verificada de nyu.edu - Página principal
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Does the hydrated electron occupy a cavity?
RE Larsen, WJ Glover, BJ Schwartz
Science 329 (5987), 65-69, 2010
2622010
Ab initio multiple cloning algorithm for quantum nonadiabatic molecular dynamics
DV Makhov, WJ Glover, TJ Martinez, DV Shalashilin
The Journal of chemical physics 141 (5), 2014
2042014
Role of Rydberg states in the photochemical dynamics of ethylene
T Mori, WJ Glover, MS Schuurman, TJ Martinez
The Journal of Physical Chemistry A 116 (11), 2808-2818, 2012
1492012
Response to comments on “Does the hydrated electron occupy a cavity?”
RE Larsen, WJ Glover, BJ Schwartz
Science 331 (6023), 1387-1387, 2011
1172011
Raman spectra of ionic liquids: A simulation study of and its mixtures with alkali chlorides
WJ Glover, PA Madden
The Journal of chemical physics 121 (15), 7293-7303, 2004
952004
Ultrafast internal conversion in ethylene. II. Mechanisms and pathways for quenching and hydrogen elimination
TK Allison, H Tao, WJ Glover, TW Wright, AM Stooke, C Khurmi, ...
The Journal of chemical physics 136 (12), 2012
882012
The structure of the hydrated electron. Part 2. A mixed quantum/classical molecular dynamics embedded cluster density functional theory: single− excitation configuration …
IA Shkrob, WJ Glover, RE Larsen, BJ Schwartz
The Journal of Physical Chemistry A 111 (24), 5232-5243, 2007
702007
Between ethylene and polyenes-the non-adiabatic dynamics of cis-dienes
TS Kuhlman, WJ Glover, T Mori, KB Møller, TJ Martínez
Faraday discussions 157, 193-212, 2012
632012
Excited state non-adiabatic dynamics of the smallest polyene, trans 1, 3-butadiene. II. Ab initio multiple spawning simulations
WJ Glover, T Mori, MS Schuurman, AE Boguslavskiy, O Schalk, A Stolow, ...
The Journal of chemical physics 148 (16), 2018
572018
A computationally efficient exact pseudopotential method. I. Analytic reformulation of the Phillips-Kleinman theory
CJ Smallwood, RE Larsen, WJ Glover, BJ Schwartz
The Journal of chemical physics 125 (7), 2006
542006
Excited state non-adiabatic dynamics of the smallest polyene, trans 1, 3-butadiene. I. Time-resolved photoelectron-photoion coincidence spectroscopy
AE Boguslavskiy, O Schalk, N Gador, WJ Glover, T Mori, T Schultz, ...
The Journal of chemical physics 148 (16), 2018
422018
Free energies of cavity and noncavity hydrated electrons near the instantaneous air/water interface
JR Casey, BJ Schwartz, WJ Glover
The journal of physical chemistry letters 7 (16), 3192-3198, 2016
422016
Short-range electron correlation stabilizes noncavity solvation of the hydrated electron
WJ Glover, BJ Schwartz
Journal of chemical theory and computation 12 (10), 5117-5131, 2016
352016
The roles of electronic exchange and correlation in charge-transfer-to-solvent dynamics: Many-electron nonadiabatic mixed quantum/classical simulations of photoexcited sodium …
WJ Glover, RE Larsen, BJ Schwartz
The Journal of chemical physics 129 (16), 2008
322008
Fragment quantum mechanical method for excited states of proteins: Development and application to the green fluorescent protein
X Jin, WJ Glover, X He
Journal of Chemical Theory and Computation 16 (8), 5174-5188, 2020
312020
Comparison of S, Pt, and Hf adsorption on NiAl (1 1 0)
KM Carling, W Glover, H Gunaydin, TA Mitchell, EA Carter
Surface science 600 (10), 2079-2090, 2006
312006
Temperature dependence of the hydrated electron’s excited-state relaxation. I. Simulation predictions of resonance Raman and pump-probe transient absorption spectra of cavity …
CC Zho, EP Farr, WJ Glover, BJ Schwartz
The Journal of chemical physics 147 (7), 2017
302017
First principles multielectron mixed quantum/classical simulations in the condensed phase. I. An efficient Fourier-grid method for solving the many-electron problem
WJ Glover, RE Larsen, BJ Schwartz
The Journal of chemical physics 132 (14), 2010
272010
Nature of Sodium Atoms/(Na+, e) Contact Pairs in Liquid Tetrahydrofuran
WJ Glover, RE Larsen, BJ Schwartz
The Journal of Physical Chemistry B 114 (35), 11535-11543, 2010
242010
Communication: Smoothing out excited-state dynamics: Analytical gradients for dynamically weighted complete active space self-consistent field
WJ Glover
The Journal of Chemical Physics 141 (17), 2014
232014
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Artículos 1–20