Comparison of ab Initio and DFT Electronic Structure...

Journal of Physical Chemistry A 2007 / 12 Vol. 111; Iss. 50

Comparison of ab Initio and DFT Electronic Structure Methods for Peptides Containing an Aromatic Ring:  Effect of Dispersion and BSSE

Shields, Ashley E., van Mourik, Tanja
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Volume:
111
Language:
english
Journal:
The Journal of Physical Chemistry A
DOI:
10.1021/jp076496p
Date:
December, 2007
File:
PDF, 130 KB
english, 2007
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