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Alex Thom
University of Cambridge - Cambridge / United Kingdom
Natural Sciences / Chemical Sciences
AD Scientific Index ID: 1332065
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Alex Thom's MOST POPULAR ARTICLES
1-)
Advances in molecular quantum chemistry contained in the Q-Chem 4 program packageY Shao, Z Gan, E Epifanovsky, ATB Gilbert, M Wormit, J Kussmann, ...Molecular Physics 113 (2), 184-215, 201526332015
2-)
Fermion Monte Carlo without fixed nodes: A game of life, death, and annihilation in Slater determinant spaceGH Booth, AJW Thom, A AlaviThe Journal of chemical physics 131 (5), 054106, 20096812009
3-)
Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 packageE Epifanovsky, ATB Gilbert, X Feng, J Lee, Y Mao, N Mardirossian, ...The Journal of Chemical Physics 155 (8), 084801, 20212282021
4-)
Breaking the carbon dimer: the challenges of multiple bond dissociation with full configuration interaction quantum Monte Carlo methodsGH Booth, D Cleland, AJW Thom, A AlaviThe Journal of chemical physics 135 (8), 084104, 20111782011
5-)
LOBA: a localized orbital bonding analysis to calculate oxidation states, with application to a model water oxidation catalystAJW Thom, EJ Sundstrom, M Head-GordonPhysical Chemistry Chemical Physics 11 (47), 11297-11304, 20091672009
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