JACS Au (Aug 2021)

Quantifying the Impact of Parametric Uncertainty on Automatic Mechanism Generation for CO2 Hydrogenation on Ni(111)

  • Bjarne Kreitz,
  • Khachik Sargsyan,
  • Katrín Blöndal,
  • Emily J. Mazeau,
  • Richard H. West,
  • Gregor D. Wehinger,
  • Thomas Turek,
  • C. Franklin Goldsmith

DOI
https://doi.org/10.1021/jacsau.1c00276
Journal volume & issue
Vol. 1, no. 10
pp. 1656 – 1673

Abstract

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