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Malone, Fionn D.
85
results:
Search for persons
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Format
Online (85)
Mediatypes
Articles (Online) (25)
OpenAccess-fulltext (60)
Languages
english (34)
spanish (1)
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1
Quantum computation of stopping power for inertial fusion t..:
Rubin, Nicholas C.
;
Berry, Dominic W.
;
Kononov, Alina
...
Proceedings of the National Academy of Sciences. 121 (2024) 23 - p. , 2024
Link:
https://doi.org/10.1073/..
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2
Fault-Tolerant Quantum Simulation of Materials Using Bloch ..:
Rubin, Nicholas C.
;
Berry, Dominic W.
;
Malone, Fionn D.
...
PRX Quantum. 4 (2023) 4 - p. , 2023
Link:
https://doi.org/10.1103/..
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3
Accurate non-covalent interaction energies on noisy interme..:
Loipersberger, Matthias
;
Malone, Fionn D.
;
Welden, Alicia R.
...
Chemical Science. 14 (2023) 13 - p. 3587-3599 , 2023
Link:
https://doi.org/10.1039/..
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4
Towards the simulation of large scale protein–ligand intera..:
Malone, Fionn D.
;
Parrish, Robert M.
;
Welden, Alicia R.
...
Chemical Science. 13 (2022) 11 - p. 3094-3108 , 2022
Link:
https://doi.org/10.1039/..
?
5
ipie: A Python-Based Auxiliary-Field Quantum Monte Carlo Pr..:
Malone, Fionn D.
;
Mahajan, Ankit
;
Spencer, James S.
.
Journal of Chemical Theory and Computation. 19 (2022) 1 - p. 109-121 , 2022
Link:
https://doi.org/10.1021/..
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6
A phaseless auxiliary-field quantum Monte Carlo perspective..:
Lee, Joonho
;
Morales, Miguel A.
;
Malone, Fionn D.
The Journal of Chemical Physics. 154 (2021) 6 - p. , 2021
Link:
https://doi.org/10.1063/..
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7
Spectral Functions from Auxiliary-Field Quantum Monte Carlo..:
Lee, Joonho
;
Malone, Fionn D.
;
Morales, Miguel A.
.
Journal of Chemical Theory and Computation. 17 (2021) 6 - p. 3372-3387 , 2021
Link:
https://doi.org/10.1021/..
?
8
Accelerating Auxiliary-Field Quantum Monte Carlo Simulation..:
Malone, Fionn D.
;
Zhang, Shuai
;
Morales, Miguel A.
Journal of Chemical Theory and Computation. 16 (2020) 7 - p. 4286-4297 , 2020
Link:
https://doi.org/10.1021/..
?
9
Utilizing Essential Symmetry Breaking in Auxiliary-Field Qu..:
Lee, Joonho
;
Malone, Fionn D.
;
Morales, Miguel A.
Journal of Chemical Theory and Computation. 16 (2020) 5 - p. 3019-3027 , 2020
Link:
https://doi.org/10.1021/..
?
10
The performance of phaseless auxiliary-field quantum Monte ..:
Lee, Joonho
;
Malone, Fionn D.
;
Reichman, David R.
The Journal of Chemical Physics. 153 (2020) 12 - p. , 2020
Link:
https://doi.org/10.1063/..
?
11
Using Density Matrix Quantum Monte Carlo for Calculating Ex..:
Petras, Hayley R.
;
Ramadugu, Sai Kumar
;
Malone, Fionn D.
.
Journal of Chemical Theory and Computation. 16 (2020) 2 - p. 1029-1038 , 2020
Link:
https://doi.org/10.1021/..
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12
QMCPACK: Advances in the development, efficiency, and appli..:
Kent, P. R. C.
;
Annaberdiyev, Abdulgani
;
Benali, Anouar
...
The Journal of Chemical Physics. 152 (2020) 17 - p. , 2020
Link:
https://doi.org/10.1063/..
?
13
Accelerating the convergence of auxiliary-field quantum Mon..:
Morales, Miguel A.
;
Malone, Fionn D.
The Journal of Chemical Physics. 153 (2020) 19 - p. , 2020
Link:
https://doi.org/10.1063/..
?
14
The HANDE-QMC Project: Open-Source Stochastic Quantum Chemi..:
Spencer, James S.
;
Blunt, Nick S.
;
Choi, Seonghoon
...
Journal of Chemical Theory and Computation. 15 (2019) 3 - p. 1728-1742 , 2019
Link:
https://doi.org/10.1021/..
?
15
An auxiliary-Field quantum Monte Carlo perspective on the g..:
Lee, Joonho
;
Malone, Fionn D.
;
Morales, Miguel A.
The Journal of Chemical Physics. 151 (2019) 6 - p. , 2019
Link:
https://doi.org/10.1063/..
1-15