Rotationally and orbitally adiabatic basis sets for electron-molecule scattering

Nancy Ann Mulllaney, Donald G. Truhlar

Research output: Contribution to journalArticlepeer-review

21 Scopus citations

Abstract

We have applied the close coupling method with conventional, l-dominant, and adiabatic basis functions to electron-molecule elastic scattering and rotational excitation. We show that accurate results may be obtained with small adiabatic basis sets.

Original languageEnglish (US)
Pages (from-to)512-517
Number of pages6
JournalChemical Physics Letters
Volume58
Issue number4
DOIs
StatePublished - Oct 15 1978

Bibliographical note

Funding Information:
Supported in part by the Natiozzl Science Foundation-NatiotiScienceFouruiationGraduateFeUow. 1975-1978.

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