Lawrence B Harding

Publication Activity (10 Years)

Years Active: 2017-2021
Publications (10 Years): 9

Top Topics

Room Temperature

Density Functional Theory

Top Venues

The journal of physical chemistry. A

The journal of physical chemistry letters

The Journal of chemical physics

Journal of the American Chemical Society

This page only lists publications with an associated author ORCID identifier.

Publications

Daniel P Zaleski, Raghu Sivaramakrishnan, Hailey R Weller, Nathan A Seifert, David H Bross, Branko Ruscic, Kevin B Moore, Sarah N Elliott, Andreas V Copan, Lawrence B Harding, Stephen J Klippenstein, Robert W Field, Kirill Prozument
Substitution Reactions in the Pyrolysis of Acetone Revealed through a Modeling, Experiment, Theory Paradigm. Journal of the American Chemical Society 143 (8) (2021)
Chia-Hua Wu, D Brandon Magers, Lawrence B Harding, Stephen J Klippenstein, Wesley D Allen
Reaction Profiles and Kinetics for Radical-Radical Hydrogen Abstraction via Multireference Coupled Cluster Theory. Journal of chemical theory and computation 16 (3) (2020)
Ahren W Jasper, Lawrence B Harding, Christopher Knight, Yuri Georgievskii
Anharmonic Rovibrational Partition Functions at High Temperatures: Tests of Reduced-Dimensional Models for Systems with up to Three Fluxional Modes. The journal of physical chemistry. A 123 (29) (2019)
David H Bross, Hua-Gen Yu, Lawrence B Harding, Branko Ruscic
Active Thermochemical Tables: The Partition Function of Hydroxymethyl (CH2OH) Revisited. The journal of physical chemistry. A 123 (19) (2019)
Mark Pfeifle, Yong-Tao Ma, Ahren W Jasper, Lawrence B Harding, William L Hase, Stephen J Klippenstein
Nascent energy distribution of the Criegee intermediate CH2OO from direct dynamics calculations of primary ozonide dissociation. The Journal of chemical physics 148 (17) (2018)
Ahren W Jasper, Zackery B Gruey, Lawrence B Harding, Yuri Georgievskii, Stephen J Klippenstein, Albert F Wagner
Anharmonic Rovibrational Partition Functions for Fluxional Species at High Temperatures via Monte Carlo Phase Space Integrals. The journal of physical chemistry. A 122 (6) (2018)
Stephen J Klippenstein, Lawrence B Harding, Branko Ruscic
Ab Initio Computations and Active Thermochemical Tables Hand in Hand: Heats of Formation of Core Combustion Species. The journal of physical chemistry. A 121 (35) (2017)
Lawrence B Harding, Yuri Georgievskii, Stephen J Klippenstein
Accurate Anharmonic Zero-Point Energies for Some Combustion-Related Species from Diffusion Monte Carlo. The journal of physical chemistry. A 121 (22) (2017)
Daniel P Zaleski, Lawrence B Harding, Stephen J Klippenstein, Branko Ruscic, Kirill Prozument
Time-Resolved Kinetic Chirped-Pulse Rotational Spectroscopy in a Room-Temperature Flow Reactor. The journal of physical chemistry letters 8 (24) (2017)