Quadrupolar NMR spin relaxation calculated using Ab initio molecular dynamics: Group 1 and group 17 ions in aqueous solution

Journal of Chemical Theory and Computation

Volumn 9, Issue 9, 2013, Pages 4074-4086

  Badu, Shyam ^a   Truflandier, Lionel ^b   Autschbach, Jochen ^a  

^a UNIVERSITY AT BUFFALO   (United States)

^b INSTITUT DES SCIENCES MOLÉCULAIRES   (France)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 84884177219     PISSN: 15499618     EISSN: 15499626     Source Type: Journal    
DOI: 10.1021/ct400419s     Document Type: Article

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