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Theoretical study of N28 molecule using semiempirical MO methods

โœ Scribed by Cheng Chen; Kuang-Chung Sun


Book ID
113258794
Publisher
Elsevier Science
Year
1996
Tongue
English
Weight
419 KB
Volume
362
Category
Article
ISSN
0166-1280

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โœ Derek Higgins; Colin Thomson ๐Ÿ“‚ Article ๐Ÿ“… 1988 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 899 KB

The conformational potential energy surface as a function of the two internal torsion angles in C-nitrosomethanol has been obtained using the semiempirical AM1 method. Optimized geometries are reported for the local minima on this surface and also for the corresponding points on the HF/6-31G, 6-31G\