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Kimihiko Hirao:
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Publications of Author
- Takeshi Yanai, Haruyuki Nakano, Takahito Nakajima, Takao Tsuneda, So Hirata, Yukio Kawashima, Yoshihide Nakao, Muneaki Kamiya, Hideo Sekino, Kimihiko Hirao
UTChem - A Program for ab initio Quantum Chemistry. [Citation Graph (0, 0)][DBLP] International Conference on Computational Science, 2003, pp:84-95 [Conf]
- Yoshinao Nakagawa, Nobuo Tajima, Kimihiko Hirao
A theoretical study of catalytic hydration reactions of ethylene. [Citation Graph (0, 0)][DBLP] Journal of Computational Chemistry, 2000, v:21, n:14, pp:1292-1304 [Journal]
- Takahito Nakajima, Takeshi Yanai, Kimihiko Hirao
Relativistic electronic structure theory. [Citation Graph (0, 0)][DBLP] Journal of Computational Chemistry, 2002, v:23, n:8, pp:847-860 [Journal]
- Haruyuki Nakano, Ryuma Uchiyama, Kimihiko Hirao
Quasi-degenerate perturbation theory with general multiconfiguration self-consistent field reference functions. [Citation Graph (0, 0)][DBLP] Journal of Computational Chemistry, 2002, v:23, n:12, pp:1166-1175 [Journal]
- Takao Tsuneda, Muneaki Kamiya, Kimihiko Hirao
Regional self-interaction correction of density functional theory. [Citation Graph (0, 0)][DBLP] Journal of Computational Chemistry, 2003, v:24, n:13, pp:1592-1598 [Journal]
- Henryk A. Witek, Yoong-Kee Choe, James P. Finley, Kimihiko Hirao
Intruder state avoidance multireference Møller-Plesset perturbation theory. [Citation Graph (0, 0)][DBLP] Journal of Computational Chemistry, 2002, v:23, n:10, pp:957-965 [Journal]
- Henryk A. Witek, Haruyuki Nakano, Kimihiko Hirao
Multireference perturbation theory with optimized partitioning. II. Applications to molecular systems. [Citation Graph (0, 0)][DBLP] Journal of Computational Chemistry, 2003, v:24, n:12, pp:1390-1400 [Journal]
- Susumu Yanagisawa, Takao Tsuneda, Kimihiko Hirao
Investigation of the use of density functionals in second- and third-row transition metal dimer calculations. [Citation Graph (0, 0)][DBLP] Journal of Computational Chemistry, 2001, v:22, n:16, pp:1995-2009 [Journal]
- Ram Kinkar Roy, V. Usha, Bhisma K. Patel, Kimihiko Hirao
Acetalization and thioacetalization of cabonyl compounds: A case study based on global and local electrophilicity descriptors. [Citation Graph (0, 0)][DBLP] Journal of Computational Chemistry, 2006, v:27, n:6, pp:773-780 [Journal]
The next-generation supercomputer project and a plan for the advanced institute for computational science. [Citation Graph (, )][DBLP]
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