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Vibrational frequencies for N 4
Journal article

Vibrational frequencies for N 4

Karl Sohlberg
Journal of molecular structure. Theochem, v 339(1)
1995

Abstract

Vibrational frequencies for the nitrogen dimer cation N 4 + have been calculated with ab initio self-consistent-field methods. The results are compared with infrared absorption results from the literature. The unrestricted Hartree-Fock method is found to give vibrational frequencies in very good agreement with the experimental results, producing for the first time a complete and reasonably reliable set of vibrational frequencies for N 4 +.

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Web of Science research areas
Chemistry, Physical
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