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Anh Reynolds
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Cited by
Year
Combined fragmentation method: A simple method for fragmentation of large molecules
HA Le, HJ Tan, JF Ouyang, RPA Bettens
Journal of chemical theory and computation 8 (2), 469-478, 2012
952012
Accurately reproducing ab initio electrostatic potentials with multipoles and fragmentation
HA Le, AM Lee, RPA Bettens
The Journal of Physical Chemistry A 113 (39), 10527-10533, 2009
362009
Reaction Dynamics of H3+ + CO on an Interpolated Potential Energy Surface
HA Le, TJ Frankcombe, MA Collins
The Journal of Physical Chemistry A 114 (40), 10783-10788, 2010
162010
A theoretical study on cyclacenes: Analytical tight‐binding approach
S Battaglia, H Le, GL Bendazzoli, N Faginas‐Lago, T Leininger, ...
International Journal of Quantum Chemistry 118 (12), e25569, 2018
102018
Distributed multipoles and energies of flexible molecules
HA Le, RPA Bettens
Journal of Chemical Theory and Computation 7 (4), 921-930, 2011
92011
Occupied-orbital fast multipole method for efficient exact exchange evaluation
HA Le, T Shiozaki
Journal of Chemical Theory and Computation 14 (3), 1228-1234, 2018
72018
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