ACS Omega (Oct 2019)

Tools for Prescreening the Most Active Sites on Ir and Rh Clusters toward C–H Bond Cleavage of Ethane: NBO Charges and Wiberg Bond Indexes

  • Yingbin Ge,
  • Anna Le,
  • Gregory J. Marquino,
  • Phuc Q. Nguyen,
  • Kollin Trujillo,
  • Morgan Schimelfenig,
  • Ashley Noble

DOI
https://doi.org/10.1021/acsomega.9b02813
Journal volume & issue
Vol. 4, no. 20
pp. 18809 – 18819

Abstract

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