James Gardner

5PUBLICATIONS
10CO-AUTHORS
Radiation and matterTheoretical quantum chemistryQuantum computationMolecular and organic electronics
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Publications (5)

|Dec 27, 2023
Machine Learning Interatomic Potentials for Reactive Hydrogen Dynamics at Metal Surfaces Based on Iterative Refinement of Reaction Probabilities.

Wojciech G Stark, Julia Westermayr, Oscar A Douglas-Gallardo

|Aug 16, 2023
Assessing Mixed Quantum-Classical Molecular Dynamics Methods for Nonadiabatic Dynamics of Molecules on Metal Surfaces.

James Gardner, Scott Habershon, Reinhard J Maurer

|Feb 15, 2023
Efficient implementation and performance analysis of the independent electron surface hopping method for dynamics at metal surfaces.

James Gardner, Daniel Corken, Svenja M Janke

|May 07, 2022
NQCDynamics.jl: A Julia package for nonadiabatic quantum classical molecular dynamics in the condensed phase.

James Gardner, Oscar A Douglas-Gallardo, Wojciech G Stark

|Nov 10, 2021
The stabilization potential of a standing molecule.

Marvin Knol, Hadi H Arefi, Daniel Corken

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