Extension of the Method of Complex Basis Functions to Molecular Resonances

C. W. McCurdy, Jr. and T. N. Rescigno
Phys. Rev. Lett. 41, 1364 – Published 13 November 1978
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Abstract

We consider the extension of the complex-coordinate technique to the problem of locating molecular resonances. We suggest a method which uses complex normalizable functions and which becomes equivalent to the usual dilatation transformation asymptotically, but is different for small values of the electronic coordinates. The technique is illustrated by application to the bound states of H2+ and to a model nonspherical resonance problem.

  • Received 26 May 1978

DOI:https://doi.org/10.1103/PhysRevLett.41.1364

©1978 American Physical Society

Authors & Affiliations

C. W. McCurdy, Jr.

  • Department of Chemistry, The Ohio State University, Columbus, Ohio 43210

T. N. Rescigno*

  • Theoretical Atomic and Molecular Physics Group, Lawrence Livermore Laboratory, University of California, Livermore, California 94550

  • *Author to whom correspondence should be addressed.

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Issue

Vol. 41, Iss. 20 — 13 November 1978

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