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Cody A. Melton
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QMCPACK: an open source ab initio quantum Monte Carlo package for the electronic structure of atoms, molecules and solids
J Kim, AD Baczewski, TD Beaudet, A Benali, MC Bennett, MA Berrill, ...
Journal of Physics: Condensed Matter 30 (19), 195901, 2018
2772018
QMCPACK: Advances in the development, efficiency, and application of auxiliary field and real-space variational and diffusion quantum Monte Carlo
PRC Kent, A Annaberdiyev, A Benali, MC Bennett, EJ Landinez Borda, ...
The Journal of chemical physics 152 (17), 2020
1072020
A new generation of effective core potentials for correlated calculations
MC Bennett, CA Melton, A Annaberdiyev, G Wang, L Shulenburger, ...
The Journal of chemical physics 147 (22), 2017
1062017
A new generation of effective core potentials from correlated calculations: 3d transition metal series
A Annaberdiyev, G Wang, CA Melton, MC Bennett, L Shulenburger, ...
The Journal of chemical physics 149 (13), 2018
722018
A new generation of effective core potentials from correlated calculations: 2nd row elements
MC Bennett, G Wang, A Annaberdiyev, CA Melton, L Shulenburger, ...
The Journal of chemical physics 149 (10), 2018
592018
A new generation of effective core potentials from correlated calculations: 4s and 4p main group elements and first row additions
G Wang, A Annaberdiyev, CA Melton, MC Bennett, L Shulenburger, ...
The Journal of Chemical Physics 151 (14), 2019
462019
Spin-orbit interactions in electronic structure quantum Monte Carlo methods
CA Melton, M Zhu, S Guo, A Ambrosetti, F Pederiva, L Mitas
Physical Review A 93 (4), 042502, 2016
342016
Quantum Monte Carlo with variable spins
CA Melton, MC Bennett, L Mitas
The Journal of Chemical Physics 144 (24), 2016
272016
Cohesion and excitations of diamond-structure silicon by quantum Monte Carlo: Benchmarks and control of systematic biases
A Annaberdiyev, G Wang, CA Melton, MC Bennett, L Mitas
Physical Review B 103 (20), 205206, 2021
192021
Accurate atomic correlation and total energies for correlation consistent effective core potentials
A Annaberdiyev, CA Melton, MC Bennett, G Wang, L Mitas
Journal of Chemical Theory and Computation 16 (3), 1482-1502, 2020
192020
Quantum Monte Carlo with variable spins: Fixed-phase and fixed-node approximations
CA Melton, L Mitas
Physical Review E 96 (4), 043305, 2017
132017
Many-body electronic structure of by real-space quantum Monte Carlo
CA Melton, L Mitas
Physical Review B 102 (4), 045103, 2020
122020
Projector quantum Monte Carlo with averaged vs explicit spin-orbit effects: Applications to tungsten molecular systems
CA Melton, MC Bennett, L Mitas
Journal of Physics and Chemistry of Solids 128, 367-373, 2019
72019
Fixed-node and fixed-phase approximations and their relationship to variable spins in quantum Monte Carlo
CA Melton, L Mitas
Recent Progress in Quantum Monte Carlo, 1-13, 2016
52016
Electronic structure of by fixed-node and fixed-phase diffusion Monte Carlo methods
A Annaberdiyev, CA Melton, G Wang, L Mitas
Physical Review B 106 (7), 075127, 2022
32022
Neutrinos and nucleosynthesis in core-collapse supernovae
C Fröhlich, J Casanova, M Hempel, M Liebendörfer, CA Melton, A Perego
AIP Conference Proceedings 1604 (1), 178-184, 2014
32014
Enhancing Excited State Characterization in Transition Metal Oxides Through Advanced Wavefunction Methods
A Benali, J Krogel, C Melton, R Clay, A Dumi, L Shulenburger
Bulletin of the American Physical Society, 2024
2024
Validating Spin-Orbit QMC for Equation of State Calculations of Heavy Elements
R Clay, C Melton, L Shulenburger
Bulletin of the American Physical Society, 2024
2024
Transport Coefficients of Warm Dense Matter from Kohn-Sham Density Functional Theory
C Melton, R Clay, K Cochrane, A Dumi, M Lentz
Bulletin of the American Physical Society, 2024
2024
Real-time structure and temperature measurement of gadolinium under dynamic compression
S Duwal, C McCoy, D Dolan, C Melton, M Knudson, C Seagle
Bulletin of the American Physical Society 68, 2023
2023
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Articles 1–20