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Multireference Methods are Realistic and Useful Tools for Modeling Catalysis

Catalysis Electronic Structure - Modeling Properties

Publication Details

  • Authors: J. G. Vitillo, C. J. Cramer, and L. Gagliardi
  • Publication Number: 414
  • Year: 2022
  • Journal: Isr. J. Chem.
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Full Citation

J. G. Vitillo, C. J. Cramer, and L. Gagliardi, Multireference Methods are Realistic and Useful Tools for Modeling Catalysis, Isr. J. Chem., 2022, 62, e202100136. DOI: 10.1002/ijch.202100136