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Andrew J Schultz

Showing results (11-20 of 46) with videos related to

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Journal of Chemical Theory and Computation|November 20, 2015
Quantifying Computational Effort Required for Stochastic AveragesAndrew J Schultz, David A Kofke
The Journal of Chemical Physics|December 4, 2018
Comprehensive high-precision high-accuracy equation of state and coexistence properties for classical Lennard-Jones crystals and low-temperature fluid phasesAndrew J Schultz, David A Kofke
The Journal of Chemical Physics|June 3, 2019
Application of the interface potential approach for studying wetting behavior within a molecular dynamics frameworkKarnesh Jain, Andrew J Schultz, Jeffrey R Errington
The Journal of Physical Chemistry. B|July 14, 2021
Coupled Monte Carlo and Molecular Dynamics Simulations on Interfacial Properties of Antifouling Polymer MembranesYiqi Chen, Andrew J Schultz, Jeffrey R Errington
The Journal of Physical Chemistry. B|June 24, 2021
Evaluation of Osmotic Virial Coefficients via Restricted Gibbs Ensemble Simulations, with Support from Gas-Phase Mixture CoefficientsArpit Bansal, Andrew J Schultz, David A Kofke
The Journal of Chemical Physics|August 3, 2019
Construction of the interface potential from a series of canonical ensemble simulationsKarnesh Jain, Andrew J Schultz, Jeffrey R Errington
The Journal of Chemical Physics|January 10, 2020
Implementation of harmonically mapped averaging in LAMMPS, and effect of potential truncation on anharmonic propertiesApoorva Purohit, Andrew J Schultz, David A Kofke
The Journal of Chemical Physics|October 15, 2010
Efficient calculation of temperature dependence of solid-phase free energies by overlap sampling coupled with harmonically targeted perturbationTai Boon Tan, Andrew J Schultz, David A Kofke
The Journal of Chemical Physics|June 10, 2010
Suitability of umbrella- and overlap-sampling methods for calculation of solid-phase free energies by molecular simulationTai Boon Tan, Andrew J Schultz, David A Kofke
Scientific Reports|May 10, 2018
No system-size anomalies in entropy of bcc iron at Earth's inner-core conditionsAndrew J Schultz, Sabry G Moustafa, David A Kofke
Pageof 5

Showing results (11-20 of 46) with videos related to

Sort By:
Pageof 5
Journal of Chemical Theory and Computation|November 20, 2015
Quantifying Computational Effort Required for Stochastic AveragesAndrew J Schultz, David A Kofke
The Journal of Chemical Physics|December 4, 2018
Comprehensive high-precision high-accuracy equation of state and coexistence properties for classical Lennard-Jones crystals and low-temperature fluid phasesAndrew J Schultz, David A Kofke
The Journal of Chemical Physics|June 3, 2019
Application of the interface potential approach for studying wetting behavior within a molecular dynamics frameworkKarnesh Jain, Andrew J Schultz, Jeffrey R Errington
The Journal of Physical Chemistry. B|July 14, 2021
Coupled Monte Carlo and Molecular Dynamics Simulations on Interfacial Properties of Antifouling Polymer MembranesYiqi Chen, Andrew J Schultz, Jeffrey R Errington
The Journal of Physical Chemistry. B|June 24, 2021
Evaluation of Osmotic Virial Coefficients via Restricted Gibbs Ensemble Simulations, with Support from Gas-Phase Mixture CoefficientsArpit Bansal, Andrew J Schultz, David A Kofke
The Journal of Chemical Physics|August 3, 2019
Construction of the interface potential from a series of canonical ensemble simulationsKarnesh Jain, Andrew J Schultz, Jeffrey R Errington
The Journal of Chemical Physics|January 10, 2020
Implementation of harmonically mapped averaging in LAMMPS, and effect of potential truncation on anharmonic propertiesApoorva Purohit, Andrew J Schultz, David A Kofke
The Journal of Chemical Physics|October 15, 2010
Efficient calculation of temperature dependence of solid-phase free energies by overlap sampling coupled with harmonically targeted perturbationTai Boon Tan, Andrew J Schultz, David A Kofke
The Journal of Chemical Physics|June 10, 2010
Suitability of umbrella- and overlap-sampling methods for calculation of solid-phase free energies by molecular simulationTai Boon Tan, Andrew J Schultz, David A Kofke
Scientific Reports|May 10, 2018
No system-size anomalies in entropy of bcc iron at Earth's inner-core conditionsAndrew J Schultz, Sabry G Moustafa, David A Kofke
Pageof 5