Journal
CHEMICAL PHYSICS LETTERS
Volume 391, Issue 1-3, Pages 143-147Publisher
ELSEVIER SCIENCE BV
DOI: 10.1016/j.cplett.2004.04.101
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Ab initio and DFT calculations have been performed on the (CH3)(2)S-HNO3 and (CH3)(2)O-HNO3 systems. The results are discussed and compared for these complexes considering both structural and energetic consequences of the hydrogen bonding. Vibrational parameters are also presented and compared to the available experimental data. (C) 2004 Elsevier B.V. All rights reserved.
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