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Valance state ionization potentials of elements in the second transition period

โœ Scribed by V. I. Baranovskii; A. B. Nikol'skii


Book ID
112482173
Publisher
Springer
Year
1970
Tongue
English
Weight
405 KB
Volume
3
Category
Article
ISSN
0040-5760

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Study of transition-state methods in the
โœ Patrick Duffy; Delano P. Chong ๐Ÿ“‚ Article ๐Ÿ“… 1993 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 428 KB

The vertical ionization potentials of nine small molecules were computed by the deMon density functional program and different versions of the transition-state method and the results were compared with earlier calculations and with experiment. The average absolute deviation of the 38 computed ioniza