Accurate Prediction of Acidity Constants in Aqueous...

Journal of Physical Chemistry A 2002 / 02 Vol. 106; Iss. 7

Accurate Prediction of Acidity Constants in Aqueous Solution via Density Functional Theory and Self-Consistent Reaction Field Methods

Klicić, Jasna J., Friesner, Richard A., Liu, Shi-Yi, Guida, Wayne C.
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Volume:
106
Language:
english
Journal:
The Journal of Physical Chemistry A
DOI:
10.1021/jp012533f
Date:
February, 2002
File:
PDF, 63 KB
english, 2002
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