Data for: "Electron Transfer and Hydride Transfer Pathways in the Stoltz-Grubbs Reducing System (KOtBu-Et3SiH)"

Dataset

Description

Density Functional Theory (DFT) log files and selected fchk files (for species with spin density presented), for the following paper:
Electron Transfer and Hydride Transfer Pathways in the Stoltz-Grubbs Reducing System (KOtBu-Et3SiH)
Date made available12 Sep 2017
PublisherUniversity of Strathclyde
Date of data productionOct 2016 - Sep 2017

Cite this

Young, A. (Creator). (12 Sep 2017). Data for: "Electron Transfer and Hydride Transfer Pathways in the Stoltz-Grubbs Reducing System (KOtBu-Et3SiH)". University of Strathclyde. Gaussian09_FCHK_Files(.zip), Gaussian09_Log_Files(.zip). 10.15129/fece83f2-ac55-4020-a865-a57aee7d1368