A DFT INVESTIGATION ON BASIS SET SIZE AND HYDROGEN-BONDING...

Journal of Theoretical and Computational Chemistry 2013 / 06 Vol. 12; Iss. 4

A DFT INVESTIGATION ON BASIS SET SIZE AND HYDROGEN-BONDING EFFECTS ON 17 O AND 2 H NQR PARAMETERS

ESRAFILI, MEHDI D., MOHAMMADIRAD, NAFISEH
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Volume:
12
Language:
english
Journal:
Journal of Theoretical and Computational Chemistry
DOI:
10.1142/S0219633613500223
Date:
June, 2013
File:
PDF, 345 KB
english, 2013
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