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James M. Goff
James M. Goff
Verified email at sandia.gov
Title
Cited by
Cited by
Year
FitSNAP: Atomistic machine learning with LAMMPS
A Rohskopf, C Sievers, N Lubbers, MA Cusentino, J Goff, J Janssen, ...
Journal of Open Source Software 8 (84), 5118, 2023
562023
Single-step direct laser writing of multimetal oxygen evolution catalysts from liquid precursors
S McGee, Y Lei, J Goff, CJ Wilkinson, NN Nova, CM Kindle, F Zhang, ...
ACS nano 15 (6), 9796-9807, 2021
192021
Predicting the pseudocapacitive windows for MXene electrodes with voltage-dependent cluster expansion models
JM Goff, F Marques dos Santos Vieira, ND Keilbart, Y Okada, I Dabo
ACS Applied Energy Materials 4 (4), 3151-3159, 2021
172021
MXene electrode materials for electrochemical energy storage: First-principles and grand canonical Monte Carlo Simulations
Y Okada, N Keilbart, JM Goff, S Higai, K Shiratsuyu, I Dabo
MRS Advances 4 (33-34), 1833-1841, 2019
142019
Permutation-adapted complete and independent basis for atomic cluster expansion descriptors
JM Goff, C Sievers, MA Wood, AP Thompson
Journal of Computational Physics 510, 113073, 2024
112024
Exploring model complexity in machine learned potentials for simulated properties
A Rohskopf, J Goff, D Sema, K Gordiz, NC Nguyen, A Henry, ...
Journal of Materials Research 38 (24), 5136-5150, 2023
102023
Shadow molecular dynamics and atomic cluster expansions for flexible charge models
J Goff, Y Zhang, C Negre, A Rohskopf, AMN Niklasson
Journal of chemical theory and computation 19 (13), 4255-4272, 2023
102023
Direct laser writing of multimetal bifunctional catalysts for overall water splitting
S McGee, A Fest, C Chandler, NN Nova, Y Lei, J Goff, SB Sinnott, I Dabo, ...
ACS Applied Energy Materials 6 (7), 3756-3768, 2023
72023
Quantifying multipoint ordering in alloys
JM Goff, BY Li, SB Sinnott, I Dabo
Physical Review B 104 (5), 054109, 2021
72021
Effects of surface charge and cluster size on the electrochemical dissolution of platinum nanoparticles using COMB3 and continuum electrolyte models
JM Goff, SB Sinnott, I Dabo
The Journal of Chemical Physics 152 (6), 2020
62020
Materials Learning Algorithms (MALA): Scalable machine learning for electronic structure calculations in large-scale atomistic simulations
A Cangi, L Fiedler, B Brzoza, K Shah, TJ Callow, D Kotik, S Schmerler, ...
Computer Physics Communications, 109654, 2025
52025
Generalized representative structures for atomistic systems
JM Goff, C Mullen, S Yang, ON Starovoytov, MA Wood
Journal of Physics: Condensed Matter 37 (7), 075901, 2024
22024
Modeling and experimentation of imperfections in materials
W Xu, CLA Leung, M Malaki, E Guo, Y Yang, JM Goff
Frontiers in Materials 11, 1473420, 2024
12024
Progress Towards a Quantum-Accurate Classical SNAP ML Interaction Potential for Gold
T Boese, I Anderson, J Schiffbauer, J Goff
Bulletin of the American Physical Society, 2025
2025
Transforming Legacy Equation of State Databases into Interatomic Potentials via Machine Learning
ES Salas, S Moore, JM Goff, MJ McCarthy, MK Lentz, NA Modine, ...
SCCM 2025, 2025
2025
Data Standards for Machine Learned Interatomic Potentials of Plasma Facing Materials
MA Wood, JM Goff
SMT 2025, 2025
2025
Tuning the electrocatalytic perfomance of mixed transition-metal hydroxides for hydrogen production
C Chandler, S McGee, A Fest, N Nova, Y Lei, J Goff, S Sinnott, I Dabo, ...
Bulletin of the American Physical Society, 2024
2024
Charge Dependent Atomic Cluster Expansions
JM Goff
Sandia National Laboratories (SNL-NM), Albuquerque, NM (United States), 2024
2024
Machine-learned ACE models with charge equilibration in LAMMPS (workshop)
JM Goff
Sandia National Laboratories (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
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Articles 1–20