Ab initio study of the isoelectronic ser
Ab initio study of the isoelectronic series N3โ, N2O and N2F+: Predicting the bond lengths in N2F+
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Nancy J.S. Peters
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Article
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1987
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Elsevier Science
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English
โ 240 KB
In view of the experimental determination of the NF bond length in NF: by Christe et al. (197 1) it is worthwhile to attempt to predict the NF bond length in N2 F+ , the NF bond with the largest known NF force constant. Calculations at the HF/4-3 1 G, HF/6-3 lG\* and MP2/6-3 IG\* levels were complet