Comparison of Direct Dynamics Simulations with Different Electronic Structure Methods. F- + CH3I with MP2 and DFT/B97-1

R Sun, C J Davada, J Zhang, William Hase

Research output: Contribution to journalArticle

Original languageEnglish
Pages (from-to)2589-2597
JournalPhysical Chemistry Chemical Physics
StatePublished - 2015

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