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Type: Artigo de periódico
Title: Dipole Moment Derivatives, Polar Tensors, And Effective Charges Of Ammonia And Phosphine
Author: Bassi A.B.M.S.
Bruns R.E.
Abstract: Preferred signs for the dipole moment derivatives of phosphine are selected on the basis of comparison of CNDO calculated values with the experimental alternatives. The atomic polar tensors, effective charges, mean dipole moment derivatives, and anisotropies for the preferred experimental values of this molecule and of ammonia are presented. A recently suggested criterion for the selection of preferred signs based on effective charge values is found to be valid for phosphine but not for ammonia.
Rights: fechado
Identifier DOI: 
Date Issue: 1976
Appears in Collections:Unicamp - Artigos e Outros Documentos

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