Search filters

List of works by Rebecca K Lindsey

Active learning for robust, high-complexity reactive atomistic simulations

scientific article published on 01 October 2020

Application of the ChIMES Force Field to Nonreactive Molecular Systems: Water at Ambient Conditions

scientific article published on 26 November 2018

Calculation of the detonation state of HN<sub>3</sub> with quantum accuracy

scientific article published on 01 December 2020

ChIMES: A Force Matched Potential with Explicit Three-Body Interactions for Molten Carbon

scientific article published on 7 November 2017

Chemistry-mediated Ostwald ripening in carbon-rich C/O systems at extreme conditions

scientific article published on 17 March 2022

Column selection for comprehensive two-dimensional liquid chromatography using the hydrophobic subtraction model

scientific article published on 13 September 2018

Development of a Multicenter Density Functional Tight Binding Model for Plutonium Surface Hydriding.

scientific article published on 3 April 2018

Many-body reactive force field development for carbon condensation in C/O systems under extreme conditions

scientific article published on 01 August 2020

Molecular simulation studies of reversed-phase liquid chromatography

scientific article published on 21 February 2013

Probing Additive Loading in the Lamellar Phase of a Nonionic Surfactant: Gibbs Ensemble Monte Carlo Simulations Using the SDK Force Field

scientific article published on 09 July 2018

Semi-Automated Creation of Density Functional Tight Binding Models through Leveraging Chebyshev Polynomial-Based Force Fields

scientific article published on 15 June 2021

Synthesis of functionalized nitrogen-containing polycyclic aromatic hydrocarbons and other prebiotic compounds in impacting glycine solutions

scientific article published on 21 May 2019

Ultrafast shock synthesis of nanocarbon from a liquid precursor

scientific article published on 17 January 2020