290 citations · 1.6k across the 46 of their papers we have counts for
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physics.comp-ph2019★ 2 cited
Relativistic density functional theory with finite-light-speed correction for the Coulomb interaction: a non-relativistic-reduction based approach
Tomoya Naito, Ryosuke Akashi, Haozhao Liang +1
The Breit correction, the finite-light-speed correction for the Coulomb interaction of the electron-electron interaction in , is introduced to density fu…
physics.comp-ph2019
AtomREM: Non-empirical seeker of the minimum energy escape paths on many-dimensional potential landscapes without coarse graining
Yuri S. Nagornov, Ryosuke Akashi
Recently a non-empirical stochastic walker algorithm has been developed to search for the minimum-energy escape paths (MEP) from the minima of the potential surface [J. Phys. Soc.…
physics.comp-ph2019★ 17 cited
Completing density functional theory by machine-learning hidden messages from molecules
Ryo Nagai, Ryosuke Akashi, Osamu Sugino
Kohn-Sham density functional theory is the base of modern computational approaches to electronic structures. Their accuracy vitally relies on the exchange-correlation energy functi…