Lowest-Lying Conformers of Alanine: Pushing Theory to Ascertain Precise Energetics and Semiexperimental Re Structures

Heather M Jaeger1, Henry F Schaefer1, Jean Demaison1

  • 1Center for Computational Chemistry and Department of Chemistry, University of Georgia, Athens, Georgia 30602, Laboratoire de Physique des Lasers, Atomes et Molécules, UMR CNRS 8523, Université de Lille I, 59655 Villeneuve d'Ascq Cedex, France, and Laboratory of Molecular Spectroscopy, Institute of Chemistry, Eötvös University, H-1518 Budapest 112, P.O. Box 32, Hungary.

Abstract

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