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An angular overlap treatment of .sigma. and .pi. bonding in f-orbital compounds

โœ Scribed by Warren, Keith D.


Book ID
127176497
Publisher
American Chemical Society
Year
1977
Tongue
English
Weight
572 KB
Volume
16
Category
Article
ISSN
0020-1669

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โœ Maged Khalil; Robert J. Woods; Donald F. Weaver; Vedene H. Smith Jr. ๐Ÿ“‚ Article ๐Ÿ“… 1991 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 908 KB

The recent NMDO/M modification and parameterization of the MNDO molecular orbital method has been used to analyze intermolecular hydrogen bonding between amino acids and water, and intramolecular hydrogen bonding in monosaccharides. The results have been compared to AM1 calculations on the same syst