Thomas L Beck (Thomas Beck)

Publication Activity (10 Years)

Years Active: 2017-2024
Publications (10 Years): 14

Top Topics

Molecular Dynamics Simulations

Top Venues

The journal of physical chemistry. B

Journal of chemical theory and computation

The journal of physical chemistry letters

The Journal of chemical physics

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

Publications

Thomas L Beck, Paolo Carloni, Dilipkumar N Asthagiri
All-Atom Biomolecular Simulation in the Exascale Era. Journal of chemical theory and computation (2024)
Thomas L Beck, Paolo Carloni, Dilipkumar N Asthagiri
All-Atom Biomolecular Simulation in the Exascale Era. Journal of chemical theory and computation 20 (5) (2024)
Dilipkumar N Asthagiri, Thomas L Beck
MD Simulation of Water Using a Rigid Body Description Requires a Small Time Step to Ensure Equipartition. Journal of chemical theory and computation 20 (1) (2023)
Dilipkumar N Asthagiri, Thomas L Beck
MD Simulation of Water Using a Rigid Body Description Requires a Small Time Step to Ensure Equipartition. Journal of chemical theory and computation (2023)
Yu Shi, Stephen T Lam, Thomas L Beck
Deep neural network based quantum simulations and quasichemical theory for accurate modeling of molten salt thermodynamics. Chemical science 13 (28) (2022)
Yu Shi, Carrie C Doyle, Thomas L Beck
Condensed Phase Water Molecular Multipole Moments from Deep Neural Network Models Trained on Ab Initio Simulation Data. The journal of physical chemistry letters 12 (42) (2021)
Andrew E Eisenhart, Thomas L Beck
Quantum Simulations of Hydrogen Bonding Effects in Glycerol Carbonate Electrolyte Solutions. The journal of physical chemistry. B 125 (8) (2021)
Henry S Ashbaugh, Dilipkumar N Asthagiri, Thomas L Beck, Susan L B Rempe
Tribute to Lawrence R. Pratt. The journal of physical chemistry. B 125 (19) (2021)
Andrew E Eisenhart, Thomas L Beck
Specific Ion Solvation and Pairing Effects in Glycerol Carbonate. The journal of physical chemistry. B 125 (50) (2021)
Carrie C Doyle, Yu Shi, Thomas L Beck
The Importance of the Water Molecular Quadrupole for Estimating Interfacial Potential Shifts Acting on Ions Near the Liquid-Vapor Interface. The journal of physical chemistry. B 123 (15) (2019)
Travis P Pollard, Thomas L Beck
Structure and polarization near the Li+ ion in ethylene and propylene carbonates. The Journal of chemical physics 147 (16) (2018)
Travis P Pollard, Thomas L Beck
Re-examining the tetraphenyl-arsonium/tetraphenyl-borate (TATB) hypothesis for single-ion solvation free energies. The Journal of chemical physics 148 (22) (2018)
Yu Shi, Thomas L Beck
Deconstructing Free Energies in the Law of Matching Water Affinities. The journal of physical chemistry. B 121 (9) (2017)
William Lum, Ian Bruzas, Zohre Gorunmez, Sarah Unser, Thomas L Beck, Laura B Sagle
Novel Liposome-Based Surface-Enhanced Raman Spectroscopy (SERS) Substrate. The journal of physical chemistry letters 8 (12) (2017)