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Disambiguation of "Nakai, Hiromi"

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Kinetic energy decomposition scheme based on information theory.

, , and . J. Comput. Chem., 34 (32): 2787-2795 (2013)

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Takeshi Nakai

Hiromi Shirai

Chiyuki Nakai

Hiromi Ishibashi

Hiromi Habata

 

Other publications of authors with the same name

Description of core excitations by time-dependent density functional theory with local density approximation, generalized gradient approximation, meta-generalized gradient approximation, and hybrid functionals., , and . J. Comput. Chem., 28 (12): 2067-2074 (2007)Extension of accompanying coordinate expansion and recurrence relation method for general-contraction basis sets., , and . J. Comput. Chem., 35 (20): 1517-1527 (2014)Colle-Salvetti-type correction for electron-nucleus correlation in the nuclear orbital plus molecular orbital theory., , and . J. Comput. Chem., 29 (5): 735-740 (2008)Dcdftbmd: Divide-and-Conquer Density Functional Tight-Binding Program for Huge-System Quantum Mechanical Molecular Dynamics Simulations., and . J. Comput. Chem., 40 (15): 1538-1549 (2019)Kinetic energy decomposition scheme based on information theory., , and . J. Comput. Chem., 34 (32): 2787-2795 (2013)Local response dispersion method in periodic systems: Implementation and assessment., , , and . J. Comput. Chem., 36 (5): 303-311 (2015)Acceleration of self-consistent field convergence in ab initio molecular dynamics simulation with multiconfigurational wave function., and . J. Comput. Chem., 35 (20): 1473-1480 (2014)Wavelet transform analysis of ab initio molecular dynamics simulation: Application to core-excitation dynamics of BF3., and . J. Comput. Chem., 28 (6): 1137-1144 (2007)Energy density analysis for second-order Møller-Plesset perturbation theory and coupled-cluster theory with singles and doubles: Application to C2H4-CH4 complexes., and . J. Comput. Chem., 29 (10): 1555-1563 (2008)Energy density analysis of cluster size dependence of surface-molecule interactions (II): Formate adsorption onto a Cu(111) surface., and . J. Comput. Chem., 27 (8): 917-925 (2006)