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  Home > JCE Print > Journal of Chemical Education > Issues > 1996  > February  >
General Interest
Spectroscopic Constants and Energetics of Metal-Containing Systems: An Experiment for the Undergraduate Computational-Chemistry Laboratory
E. G. Bakalbassis, M.-A. D. Stiakaki, A. C. Tsipis, and C. A. Tsipis
Laboratory of Applied Quantum Chemistry, Faculty of Chemistry, Aristotle University of Thessaloniki, 54006 Thessaloniki, Greece
Cover
February 1996
Vol. 73 No. 2
p. 111
Abstract
A new, safe, inexpensive, and successful undergraduate laboratory exercise that incorporates quantum chemistry is proposed based on an improved atom-superposition and electron-delocalization molecular-orbital (ASED-MO) model that is used by the students in predicting the structural, spectroscopic, and energetic properties of highly ionic metal-containing systems.
More Information
*  Citation
 Bakalbassis, E. G.; Stiakaki, M.-A. D.; Tsipis, A. C.; Tsipis, C. A. J. Chem. Educ. 1996 73 111.
*  Keywords
*  History
 Created:
Last Updated:		 9/25/1999
5/22/2006
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