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Persistent URL http://purl.org/net/epubs/work/66495
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Record Id 66495
Title A frontier orbital study with ab initio molecular dynamics of the effects of solvation on chemical reactivity: Solvent-induced orbital control in FeO-activated hydroxylation reactions
Organisation CSE-CMSG , STFC , SCI-COMP
Keywords Chemistry
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Language English (EN)
Type Details URI(s) Local file(s) Year
Journal Article J Am Chem Soc 135, no. 24 (2013): 8857-8867. 10.1021/ja311144d 2013