Analytic second derivative of the energy for density functional theory based on the three-body fragment molecular orbital method.
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Michael W. Schmidt | Shinichiro Nakamura | Kazuo Kitaura | Mark S Gordon | Federico Zahariev | Michael W Schmidt | Dmitri G Fedorov | M. Gordon | K. Kitaura | Shinichiro Nakamura | D. Fedorov | F. Zahariev | H. Nakata | Hiroya Nakata
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