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The Journal of Chemical Physics|October 23, 2012
Relativistic diffusion Monte Carlo method: zeroth-order regular approximation-diffusion Monte Carlo method in a spin-free formalismYutaka Nakatsuka, Takahito NakajimaThe Journal of Chemical Physics|May 13, 2010
Electron-nucleus cusp correction scheme for the relativistic zeroth-order regular approximation quantum Monte Carlo methodYutaka Nakatsuka, Takahito Nakajima, Kimihiko HiraoJournal of Chemical Theory and Computation|November 26, 2015
Theoretical Investigations on the Photoinduced Phase Transition Mechanism of Tetrathiafulvalene-p-chloranilYutaka Nakatsuka, Takao Tsuneda, Takeshi Sato, et al.The Journal of Chemical Physics|February 9, 2010
Relativistic quantum Monte Carlo method using zeroth-order regular approximation HamiltonianYutaka Nakatsuka, Takahito Nakajima, Maho Nakata, et al.Pageof 1