A survey of wave function effects on theoretical calculation of gas phase 19F NMR chemical shifts using factorial design

Journal of Fluorine Chemistry

Volumn 131, Issue 1, 2010, Pages 47-52

  Shaghaghi, H ^a   Ebrahimi, H ^a   Tafazzoli, M ^a   Jalali Heravi, M ^a  

^a SHARIF UNIVERSITY OF TECHNOLOGY   (Iran)

Author keywords

DFT; Factorial design; Gas phase 19F chemical shift; GIAO; MP2

Indexed keywords

EID: 71249154776     PISSN: 00221139     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jfluchem.2009.09.020     Document Type: Article

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