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A THEORETICAL INVESTIGATION OF THE $CH_{2}CN$ AMD $CH_{2}NC$ RADICALS
Rainer B. Oswald, Peter Botschwina
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Abstract
$^{1}$ MR-ACPF: Multiconfiguration Reference Average Coupled Pair Functional; R. J. Gdanitz and R. Ahlrichs. Chem Phys. Lett. 143 413 (1998). $^{2}$ CEPA-1: Couple Electron pair Approximation; W. Moyer, J. Chem. Phys. 58, 1017 (1973) $^{3}$K. Tanaka, T. Harada, Y. Sumiyoshi, and T. Tanaka, contribution B-22 at the 22nd international Symposium at Free Radicals, Doorwerth, 1993. $^{4}$M. E. Jacox, Chem Phys. 43 157 (1979); private communication (1994).