"Hideshi Ooka,Yuanqing Wang,Akira Yamaguchi,makoto hatakeyama,Shinichiro Nakamura,Kazuhito Hashimoto,Ryuhei Nakamura","Legitimate Intermediates of Oxygen Evolution on Iridium Oxide Revealed by In-situ Electrochemical Evanescent Wave Spectroscopy",,"Phys. Chem. Chem. Phys.",,"Vol. 18",,"pp. 15199-15204",2016,May
"Q. Gao,S. Yokojima,D-G. Fedorov,K. Kitaura,M. Sakurai,S. Nakamura","Octahedral point-charge model and its application to fragment molecular orbital calculations of chemical shifts",,"Chem. Phys. Lett.",,"vol. 593",,"pp. 165-173",2014,
"H. Nakata,D. G. Fedorov,S. Yokojima,K. Kitaura,M. Sakurai,S. Nakamura","Unrestricted density functional theory based on the fragment molecular orbital method for the ground and excited state calculations of large systems",,"J. Chem. Phys.",,"vol. 140",,"pp. 144101-144111",2014,
"Q. Gao,S. Yokojima,S. Nakamura,M. Sakurai","Ab initio NMR Chemical Shift Calculations for Biomolecular Systems Using Fragment Molecular Orbital Method",,"TSUBAME ESJ",,"Vol. 4",,"pp. 1-5",2011,
"Q. Gao,S. Yokojima,D. G. Fedorov,K. Kitaura,M. Sakurai,S. Nakamura","Fragment-molecular-orbital-based ab initio NMR chemical-shift calculations for large molecular systems with a cutoff distance",,"J. Chem. Theory Comput",,"Vol. 6",,"pp. 1428-1444",2010,