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The Journal of Physical Chemistry. A|June 11, 2025
OpenOrbitalOptimizer─A Reusable Open Source Library for Self-Consistent Field CalculationsSusi Lehtola, Lori A Burns
Physical Chemistry Chemical Physics : PCCP|June 23, 2010
Vibrational specificity of proton-transfer dynamics in ground-state tropoloneDaniel Murdock, Lori A Burns, Patrick H Vaccaro
The Journal of Chemical Physics|April 17, 2009
An exploration of electronic structure and nuclear dynamics in tropolone: II. The A (1)B2 (pi* pi) excited stateLori A Burns, Daniel Murdock, Patrick H Vaccaro
The Journal of Physical Chemistry. A|August 13, 2009
Dissection of rovibronic structure by polarization-resolved two-color resonant four-wave mixing spectroscopyDaniel Murdock, Lori A Burns, Patrick H Vaccaro
The Journal of Chemical Physics|June 16, 2006
An exploration of electronic structure and nuclear dynamics in tropolone. I. The X 1A1 ground stateLori A Burns, Daniel Murdock, Patrick H Vaccaro
The Journal of Chemical Physics|September 4, 2007
Mode-specific tunneling dynamics in the ground electronic state of tropoloneDaniel Murdock, Lori A Burns, Patrick H Vaccaro
The Journal of Physical Chemistry. A|November 10, 2012
Buckyplates and buckybowls: examining the effects of curvature on π-π interactionsMatthew R Kennedy, Lori A Burns, C David Sherrill
The Journal of Chemical Physics|December 22, 2014
Appointing silver and bronze standards for noncovalent interactions: a comparison of spin-component-scaled (SCS), explicitly correlated (F12), and specialized wavefunction approachesLori A Burns, Michael S Marshall, C David Sherrill
The Journal of Physical Chemistry. A|December 16, 2014
Counterion and substrate effects on barrier heights of the hydrolytic kinetic resolution of terminal epoxides catalyzed by Co(III)-salenMatthew R Kennedy, Lori A Burns, C David Sherrill
The Journal of Chemical Physics|October 15, 2024
QCManyBody: A flexible implementation of the many-body expansionLori A Burns, C David Sherrill, Benjamin P Pritchard
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