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研究業績一覧 (4件)
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論文
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Maho Nakata,
Bastiaan J. Braams,
Mituhiro Fukuda,
Jerome K. Percus,
Makoto Yamashita,
Zhengji Zhao.
Variational calculation of second-order reduced density matrices by strong N-representability conditions and an accurate semidefinite programming solver,
The Journal of Chemical Physics,
Vol. 128,
No. 16,
pp. 164113,
Apr. 2008.
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Mituhiro Fukuda,
Bastiaan J. Braams,
Maho Nakata,
Michael L. Overton,
Jerome K. Percus,
Makoto Yamashita,
Zhengji Zhao.
Large-scale semidefinite programs in electronic structure calculation,
Mathematical Programming Series B,
Vol. 109,
No. 2-3,
pp. 553-580,
2007.
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Maho Nakata,
Bastiaan J. Braams,
Mituhiro Fukuda,
Jerome K. Percus,
Makoto Yamashita,
Zhengji Zhao.
Simple Hamiltonians which exhibit drastic failures by variational determination of the two-particle reduced density matrix with some well known N-representability conditions,
The Journal of Chemical Physics,
Vol. 125,
No. 24,
pp. 244109,
2006.
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Zhengji Zhao,
Bastiaan J. Braams,
Mituhiro Fukuda,
Michael L. Overton,
Jerome K. Percus.
The reduced density matrix method for electronic structure calculations and the role of three-index representability conditions,
The Journal of Chemical Physics,
Vol. 120,
No. 5,
pp. 2095-2104,
2004.
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