Accurate Exchange-Correlation Energies for the Warm Dense Electron Gas
Malone, Fionn D, Blunt, N S, Brown, Ethan W, Lee, D K K, Spencer, J S, Foulkes, W M C, Shepherd, James J
Published in Physical review letters (09.09.2016)
Published in Physical review letters (09.09.2016)
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Neural network variational Monte Carlo for positronic chemistry
Cassella, Gino, Foulkes, W. M. C, Pfau, David, Spencer, James S
Published in Nature communications (18.06.2024)
Published in Nature communications (18.06.2024)
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The HANDE-QMC Project: Open-Source Stochastic Quantum Chemistry from the Ground State Up
Spencer, James S, Blunt, Nick S, Choi, Seonghoon, Etrych, Jiří, Filip, Maria-Andreea, Foulkes, W. M. C, Franklin, Ruth S. T, Handley, Will J, Malone, Fionn D, Neufeld, Verena A, Di Remigio, Roberto, Rogers, Thomas W, Scott, Charles J. C, Shepherd, James J, Vigor, William A, Weston, Joseph, Xu, RuQing, Thom, Alex J. W
Published in Journal of chemical theory and computation (12.03.2019)
Published in Journal of chemical theory and computation (12.03.2019)
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Discovering Quantum Phase Transitions with Fermionic Neural Networks
Cassella, Gino, Sutterud, Halvard, Azadi, Sam, Drummond, N D, Pfau, David, Spencer, James S, Foulkes, W M C
Published in Physical review letters (20.01.2023)
Published in Physical review letters (20.01.2023)
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Electron Elevator: Excitations across the Band Gap via a Dynamical Gap State
Lim, A, Foulkes, W M C, Horsfield, A P, Mason, D R, Schleife, A, Draeger, E W, Correa, A A
Published in Physical review letters (29.01.2016)
Published in Physical review letters (29.01.2016)
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Ab initio quantum chemistry with neural-network wavefunctions
Hermann, Jan, Spencer, James, Choo, Kenny, Mezzacapo, Antonio, Foulkes, W M C, Pfau, David, Carleo, Giuseppe, Noé, Frank
Published in Nature reviews. Chemistry (01.10.2023)
Published in Nature reviews. Chemistry (01.10.2023)
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Interaction picture density matrix quantum Monte Carlo
Malone, Fionn D., Blunt, N. S., Shepherd, James J., Lee, D. K. K., Spencer, J. S., Foulkes, W. M. C.
Published in The Journal of chemical physics (28.07.2015)
Published in The Journal of chemical physics (28.07.2015)
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The microscopic Einstein-de Haas effect
Wells, T, Horsfield, A P, Foulkes, W M C, Dudarev, S L
Published in The Journal of chemical physics (14.06.2019)
Published in The Journal of chemical physics (14.06.2019)
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The treatment of electronic excitations in atomistic models of radiation damage in metals
Race, C P, Mason, D R, Finnis, M W, Foulkes, W M C, Horsfield, A P, Sutton, A P
Published in Reports on progress in physics (01.11.2010)
Published in Reports on progress in physics (01.11.2010)
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Conservation laws by virtue of scale symmetries in neural systems
Fagerholm, Erik D, Foulkes, W M C, Gallero-Salas, Yasir, Helmchen, Fritjof, Friston, Karl J, Moran, Rosalyn J, Leech, Robert
Published in PLoS computational biology (01.05.2020)
Published in PLoS computational biology (01.05.2020)
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Neural Systems Under Change of Scale
Fagerholm, Erik D, Foulkes, W M C, Gallero-Salas, Yasir, Helmchen, Fritjof, Friston, Karl J, Leech, Robert, Moran, Rosalyn J
Published in Frontiers in computational neuroscience (21.04.2021)
Published in Frontiers in computational neuroscience (21.04.2021)
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Ab initio solution of the many-electron Schrödinger equation with deep neural networks
Pfau, David, Spencer, James S., Matthews, Alexander G. D. G., Foulkes, W. M. C.
Published in Physical review research (16.09.2020)
Published in Physical review research (16.09.2020)
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Electronic damping of atomic dynamics in irradiation damage of metals
Mason, D R, le Page, J, Race, C P, Foulkes, W M C, Finnis, M W, Sutton, A P
Published in Journal of physics. Condensed matter (31.10.2007)
Published in Journal of physics. Condensed matter (31.10.2007)
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The Ehrenfest approximation for electrons coupled to a phonon system
le Page, J, Mason, D R, Foulkes, W M C
Published in Journal of physics. Condensed matter (26.03.2008)
Published in Journal of physics. Condensed matter (26.03.2008)
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