Ab initio spin-coupled calculations have been carried out on MH and MH+ species to investigate the electronic structure of systems containing transition metal atoms in low oxidation states; results are presented for VH, where the bonding can be understood in terms of the overlap between a ‘bonding hybrid’ on vanadium and a distorted 1s function on hydrogen.
S. D. Loades, D. L. Cooper, J. Gerratt and M. Raimondi, J. Chem. Soc., Chem. Commun., 1989, 1604 DOI: 10.1039/C39890001604
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