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The Journal of Chemical Physics|March 5, 2008
Nonadiabatic effects in the photodetachment of ClH2(-)Millard H Alexander, Jacek Kłos, David E ManolopoulosThe Journal of Chemical Physics|February 2, 2011
Bimolecular reaction rates from ring polymer molecular dynamics: application to H + CH4 → H2 + CH3Yury V Suleimanov, Rosana Collepardo-Guevara, David E ManolopoulosThe Journal of Chemical Physics|May 12, 2009
Bimolecular reaction rates from ring polymer molecular dynamicsRosana Collepardo-Guevara, Yury V Suleimanov, David E ManolopoulosThe Journal of Chemical Physics|February 16, 2015
Nuclear quantum effects in water exchange around lithium and fluoride ionsDavid M Wilkins, David E Manolopoulos, Liem X DangThe Journal of Chemical Physics|July 23, 2004
Quantum reactive scattering with a transmission-free absorbing potentialTomas Gonzalez-Lezana, Edward J Rackham, David E ManolopoulosProceedings of the National Academy of Sciences of the United States of America|September 10, 2013
Nuclear quantum effects and hydrogen bond fluctuations in waterMichele Ceriotti, Jérôme Cuny, Michele Parrinello, et al.Physical Chemistry Chemical Physics : PCCP|January 24, 2024
Exciton dynamics from the mapping approach to surface hopping: comparison with Förster and Redfield theoriesJohan E Runeson, Thomas P Fay, David E ManolopoulosThe Journal of Chemical Physics|September 11, 2009
A fast path integral method for polarizable force fieldsGeorge S Fanourgakis, Thomas E Markland, David E ManolopoulosThe Journal of Chemical Physics|December 25, 2016
An efficient quantum mechanical method for radical pair recombination reactionsAlan M Lewis, Thomas P Fay, David E ManolopoulosThe Journal of Chemical Physics|August 17, 2017
Spin-dependent charge recombination along para-phenylene molecular wiresThomas P Fay, Alan M Lewis, David E ManolopoulosPageof 8