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Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics|October 13, 2007
Accurate forces in quantum Monte Carlo calculations with nonlocal pseudopotentialsA Badinski, R J NeedsThe Journal of Chemical Physics|December 17, 2008
Energy derivatives in quantum Monte Carlo involving the zero-variance propertyA Badinski, J R Trail, R J NeedsJournal of Physics. Condensed Matter : an Institute of Physics Journal|March 10, 2011
Methods for calculating forces within quantum Monte Carlo simulationsA Badinski, P D Haynes, J R Trail, et al.Journal of Physics. Condensed Matter : an Institute of Physics Journal|March 17, 2011
Ab initio random structure searchingChris J Pickard, R J NeedsThe Journal of Chemical Physics|February 16, 2015
Correlated electron pseudopotentials for 3d-transition metalsJ R Trail, R J NeedsThe Journal of Chemical Physics|January 11, 2005
Norm-conserving Hartree-Fock pseudopotentials and their asymptotic behaviorJ R Trail, R J NeedsJournal of Physics. Condensed Matter : an Institute of Physics Journal|June 23, 2011
Stable phases of iron at terapascal pressuresChris J Pickard, R J NeedsJournal of Chemical Theory and Computation|November 19, 2015
Comparison of Smooth Hartree-Fock PseudopotentialsJ R Trail, R J NeedsNature Materials|August 30, 2008
Highly compressed ammonia forms an ionic crystalChris J Pickard, R J NeedsPageof 5