MRD-CI calculations on the potential energy curves of the ground and excited electronic states of the noble-gas hydrides, HeH, NeH and ArH

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, , Citation G Theodorakopoulos et al 1984 J. Phys. B: Atom. Mol. Phys. 17 1453 DOI 10.1088/0022-3700/17/8/008

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1 Theoretical & Phys. Chem. Inst., Nat. Hellenic Res. Found., Athens, Greece

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0022-3700/17/8/1453

Abstract

MRD-CI calculations have been carried out for the ground- and some excited-state potential curves of He+H, Ne+H and Ar+H. Deep minima are obtained for the excited states at internuclear distances similar to those of the corresponding cations. The B2 Pi to A2 Sigma + computed transition energies do not support a previous assignment to this transition in ArH, at 7670 AA.

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