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The Journal of Chemical Physics|October 2, 2012
Extension of local response dispersion method to excited-state calculation based on time-dependent density functional theoryYasuhiro Ikabata, Hiromi NakaiPhysical Chemistry Chemical Physics : PCCP|July 19, 2021
Picture-change correction in relativistic density functional theoryYasuhiro Ikabata, Hiromi NakaiThe Journal of Physical Chemistry. A|February 11, 2011
Interpretation of intermolecular geometric isotope effect in hydrogen bonds: nuclear orbital plus molecular orbital studyYasuhiro Ikabata, Yutaka Imamura, Hiromi NakaiThe Journal of Chemical Physics|November 10, 2019
Restoring the iso-orbital limit of the kinetic energy density in relativistic density functional theoryToni M Maier, Yasuhiro Ikabata, Hiromi NakaiJournal of Chemical Theory and Computation|August 13, 2019
Efficient Semi-Numerical Implementation of Relativistic Exact Exchange within the Infinite-Order Two-Component Method Using a Modified Chain-of-Spheres MethodToni M Maier, Yasuhiro Ikabata, Hiromi NakaiThe Journal of Chemical Physics|June 8, 2020
Relativistic local hybrid functionals and their impact on 1s core orbital energiesToni M Maier, Yasuhiro Ikabata, Hiromi NakaiThe Journal of Chemical Physics|July 9, 2021
Assessing locally range-separated hybrid functionals from a gradient expansion of the exchange energy densityToni M Maier, Yasuhiro Ikabata, Hiromi NakaiJournal of Computational Chemistry|December 10, 2014
Local response dispersion method in periodic systems: Implementation and assessmentYasuhiro Ikabata, Yusuke Tsukamoto, Yutaka Imamura, et al.The Journal of Chemical Physics|April 17, 2020
Unveiling controlling factors of the S<sub>0</sub>/S<sub>1</sub> minimum energy conical intersection (2): Application to penalty function methodMayu Inamori, Yasuhiro Ikabata, Takeshi Yoshikawa, et al.The Journal of Physical Chemistry. A|September 26, 2018
Unveiling Controlling Factors of the S<sub>0</sub>/S<sub>1</sub> Minimum Energy Conical Intersection: A Theoretical StudyHiromi Nakai, Mayu Inamori, Yasuhiro Ikabata, et al.Pageof 3