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- W143808235 abstract "$^{a}$A. Ricca and C. W. Bauschlicher, Theor Chem. Acc. 106, 314, (2001). $^{b}$T. Noro, M. Sekiya, T. Koga, and H. Matsuyama, Theor Chem. Acc. 104, 146, (2000). $^{c}$P. W. Villalta and D. G. Leopold, J. Chem. Phys. 98, 7730, (1993). $^{d}$K. Tanaka, S. Sakaguchi, and T. Tanaka, J. Chem. Phys. 106, 2118, (1997)." @default.
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- W143808235 date "2002-01-01" @default.
- W143808235 modified "2023-09-27" @default.
- W143808235 title "MR-SDCI + Q AB INITIO MOLECULAR ORBITAL CALCULATIONS OF FeCO: IMPORTANCE OF WELL-CONTRIVED SA-MCSCF WAVE FUNCTIONS AND $8-10sigma$ ELECTRON CORRELATIONS" @default.
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