Showing results (1-10 of 6) with videos related to
Sort By:
Pageof 1
Physical Chemistry Chemical Physics : PCCP|June 28, 2018
Analysis of transition state stabilization by non-covalent interactions in organocatalysis: application of atomic and functional-group partitioned symmetry-adapted perturbation theory to the addition of organoboron reagents to fluoroketonesBrandon W Bakr, C David SherrillPhysical Chemistry Chemical Physics : PCCP|March 30, 2016
Analysis of transition state stabilization by non-covalent interactions in the Houk-List model of organocatalyzed intermolecular Aldol additions using functional-group symmetry-adapted perturbation theoryBrandon W Bakr, C David SherrillJournal of Chemical Theory and Computation|March 27, 2018
Understanding the Many-Body Basis Set Superposition Error: Beyond Boys and BernardiRyan M Richard, Brandon W Bakr, C David SherrillThe Journal of Chemical Physics|October 15, 2013
Highly accurate potential energy surface for the He-H2 dimerBrandon W Bakr, Daniel G A Smith, Konrad PatkowskiThe Journal of Chemical Physics|October 17, 2019
CrystaLattE: Automated computation of lattice energies of organic crystals exploiting the many-body expansion to achieve dual-level parallelismCarlos H Borca, Brandon W Bakr, Lori A Burns, et al.The Journal of Physical Chemistry Letters|May 30, 2019
Intramolecular Noncovalent Interactions Facilitate Thermally Activated Delayed Fluorescence (TADF)Xian-Kai Chen, Brandon W Bakr, Morgan Auffray, et al.Pageof 1