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Megan J. McCarthy
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FitSNAP: Atomistic machine learning with LAMMPS
A Rohskopf, C Sievers, N Lubbers, M Cusentino, J Goff, J Janssen, ...
Journal of Open Source Software 8 (84), 5118, 2023
272023
Emergence of near-boundary segregation zones in face-centered cubic multiprincipal element alloys
MJ McCarthy, H Zheng, D Apelian, WJ Bowman, H Hahn, J Luo, SP Ong, ...
Physical Review Materials 5 (11), 113601, 2021
162021
Shuffling mode competition leads to directionally anisotropic mobility of faceted Σ11 boundaries in fcc metals
MJ McCarthy, TJ Rupert
Physical Review Materials 4 (11), 113402, 2020
142020
Machine learned interatomic potential for dispersion strengthened plasma facing components
EL Sikorski, MA Cusentino, MJ McCarthy, J Tranchida, MA Wood, ...
The Journal of Chemical Physics 158 (11), 2023
122023
Chemical order transitions within extended interfacial segregation zones in NbMoTaW
D Aksoy, MJ McCarthy, I Geiger, D Apelian, H Hahn, EJ Lavernia, J Luo, ...
Journal of Applied Physics 132 (23), 2022
122022
Emergence of directionally-anisotropic mobility in a faceted Ʃ11⟨ 110⟩ tilt grain boundary in Cu
MJ McCarthy, TJ Rupert
Modelling and Simulation in Materials Science and Engineering 28 (5), 055008, 2020
52020
Alloying induces directionally-dependent mobility and alters migration mechanisms of faceted grain boundaries
MJ McCarthy, TJ Rupert
Scripta Materialia 194, 113643, 2021
42021
Atomic Representations of Local and Global Chemistry in Complex Alloys
MJ McCarthy, J Startt, R Dingreville, AP Thompson, MA Wood
arXiv preprint arXiv:2303.04311, 2023
22023
Bayesian blacksmithing: discovering thermomechanical properties and deformation mechanisms in high-entropy refractory alloys
J Startt, MJ McCarthy, MA Wood, S Donegan, R Dingreville
npj Computational Materials 10 (1), 164, 2024
12024
Dynamic formation of preferentially lattice oriented, self trapped hydrogen clusters
MA Cusentino, EL Sikorski, MJ McCarthy, AP Thompson, MA Wood
Materials Research Express 10 (10), 106513, 2023
12023
Developing machine learned potentials for high temperature applications
ES Salas, MA Cusentino, MJ McCarthy, MA Wood, AP Thompson
Sandia National Lab.(SNL-NM), Albuquerque, NM (United States), 2023
2023
Recent Developments in Machine Learning Interatomic Potentials for Molecular Dynamics
ES Salas, AD Rohskopf, JM Goff, MJ McCarthy, MA Cusentino, MA Wood, ...
Sandia National Lab.(SNL-NM), Albuquerque, NM (United States), 2023
2023
Atomistic modeling of plasma material interactions using SNAP machine learned interatomic potentials
MA Cusentino, ES Salas, MJ McCarthy, JM Goff, AD Rohskopf, MA Wood, ...
Sandia National Lab.(SNL-NM), Albuquerque, NM (United States), 2023
2023
Development of Machine Learned Interatomic Potentials for Modeling the Effect of Mixed Material Layers on Hydrogen Retention
MA Cusentino, MJ McCarthy, ES Salas, MA Wood, AP Thompson
Sandia National Lab.(SNL-NM), Albuquerque, NM (United States), 2023
2023
Machine-learned Interatomic Potential Development for H Trapping in ZrC Strengthened W
ES Salas, MA Cusentino, MJ McCarthy, J Tranchida, MA Wood, ...
Sandia National Lab.(SNL-NM), Albuquerque, NM (United States), 2023
2023
Investigating the influence of local composition on properties in complex alloys using machine learned interatomic potentials
M McCarthy, J Startt, R Dingreville, A Thompson, M Wood
APS March Meeting Abstracts 2023, Q53. 009, 2023
2023
Exploring refractory complex concentrated alloy behavior in the fusion reactor environment with a machine-learned interatomic potential.
M McCarthy, J Startt, R Dingreville, A Thompson, M Wood
Sandia National Lab.(SNL-NM), Albuquerque, NM (United States), 2022
2022
Machine Learned Interatomic Potential Development of W-ZrC for Fusion Divertor Microstructure and Thermomechanical Properties.
E Sikorski, MA Cusentino, M McCarthy, J Tranchida, M Wood, ...
Sandia National Lab.(SNL-NM), Albuquerque, NM (United States), 2022
2022
Molecular Dynamics Modeling of Hydrogen and Nitrogen Implantation in Tungsten Using Machine Learned Interatomic Potentials.
MA Cusentino, M McCarthy, E Sikorski, M Wood, A Thompson
Sandia National Lab.(SNL-NM), Albuquerque, NM (United States), 2022
2022
FitSNAP: Machine Learned Potentials for LAMMPS.
A Rohskopf, C Sievers, M McCarthy, J Goff, E Sikorski, A Thompson, ...
Sandia National Lab.(SNL-NM), Albuquerque, NM (United States), 2022
2022
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