Quantum mechanical simulation studies of molecular vibrations and dynamics of oxo-anions in water

Chemical Physics

Volumn 346, Issue 1-3, 2008, Pages 182-185

  Pribil, Andreas B ^a   Hofer, Thomas S ^a   Vchirawongkwin, Viwat ^b   Randolf, Bernhard R ^a   Rode, Bernd M ^a  

^a UNIVERSITY OF INNSBRUCK   (Austria)

^b CHULALONGKORN UNIVERSITY   (Thailand)

Author keywords

Ab initio QMCF MD; Aqueous solutions; Oxo anions; Perchlorate; Phosphate; Sulphate; VACF

Indexed keywords

EID: 43049149001     PISSN: 03010104     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.chemphys.2008.02.045     Document Type: Article

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