104 citations · 184 across the 12 of their papers we have counts for
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physics.comp-ph2026
Conserved quantities and ensemble measure for Martyna--Tobias--Klein barostats with restricted cell degrees of freedom
Kohei Shinohara
We derive the conserved energy-like quantity and ensemble measure for Martyna--Tobias--Klein (MTK) barostats in which only a restricted subset of the cell degrees of freedom are ac…
physics.comp-ph2021★ 1 cited
Finding well-optimized special quasirandom structures with decision diagram
Kohei Shinohara, Atsuto Seko, Takashi Horiyama +1
The advanced data structure of the zero-suppressed binary decision diagram (ZDD) enables us to efficiently enumerate nonequivalent substitutional structures. Not only can the ZDD s…
physics.comp-ph2020★ 3 cited
Derivative structure enumeration using binary decision diagram
Kohei Shinohara, Atsuto Seko, Takashi Horiyama +3
A derivative structure is a nonequivalent substitutional atomic configuration derived from a given primitive cell. The enumeration of derivative structures plays an essential role…