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Quantum-mechanical studies on the conformational and electronic properties of steroids

โœ Scribed by Jacqueline Caillet; Bernard Pullman


Publisher
Springer
Year
1970
Tongue
English
Weight
396 KB
Volume
17
Category
Article
ISSN
1432-2234

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Quantum chemistry studies on electronic
โœ W.F. Lin; Z.Q. Tian; S.G. Sun; Z.W. Tian ๐Ÿ“‚ Article ๐Ÿ“… 1992 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 334 KB

The electronic properties of CN-adsorbed on Ag electrodes at different potentials have been studied by using the method of self-consistent-charge discrete variational Xu (SCC-DV-Xa) cluster calculations. It is shown that the binding of -NC-Ag is dominated by both electrostatic and Polarization effec