Curve Crossings and Constraints in Molecular-Orbital Correlations

Jörg Eichler
Phys. Rev. Lett. 40, 1560 – Published 12 June 1978
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Abstract

The unexpected crossing of molecular-orbital energy curves recently observed by Fortner et al. for slightly asymmetric multiply charged collision systems is explained in the framework of a Hartree-Fock theory with a constraint enforcing unequal charge sharing between the subsystems.

  • Received 28 November 1977

DOI:https://doi.org/10.1103/PhysRevLett.40.1560

©1978 American Physical Society

Authors & Affiliations

Jörg Eichler

  • Bereich Kern - und Strahlenphysik, Hahn-Meitner-Institut für Kernforschung Berlin, GmbH, Berlin, West Germany, and Fachbereich Physik, Freie Universität Berlin, D-1000 Berlin 39, West Germany

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Issue

Vol. 40, Iss. 24 — 12 June 1978

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