Anab initio molecular orbital study of the structures and energies of neutral and charged bimolecular complexes of NH3 with the hydrides AHn (A = N, O, F, P, S, and Cl)-Reference-Cited by-同舟云学术

Anab initio molecular orbital study of the structures and energies of neutral and charged bimolecular complexes of NH3 with the hydrides AHn (A = N, O, F, P, S, and Cl)

Published:1989-07 Issue:5 Volume:10 Page:603-615
ISSN:0192-8651
Container-title:Journal of Computational Chemistry
language:en
Short-container-title:J. Comput. Chem.

Author:

Del Bene Janet E.

Publisher

Wiley

Subject

Computational Mathematics,General Chemistry

Reference72 articles.

1. SCF-CI studies of correlation effects on hydrogen bonding and ion hydration

2. The nature of the bonding of Li+ to H2O and NH3; A3 initio studies

3. The energetic effects ofp,d, andf Gaussian polarization functions on closed-shell AHn oxygen and sulfur hydrides

4. Theoretical studies of basicity. Proton affinities, lithium(1+) ion affinities, and hydrogen-bond affinities of some simple bases

5. Affinities of Ammonia and Methylamine for H+, Li+, K+and CH3+An Ab Initio SCF Study with Large Basis Sets

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