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Nuclear Energy Gradients for Internally Contracted Complete Active Space Second-Order Perturbation Theory: Multistate

Bess Vlaisavljevich1, Toru Shiozaki1

  • 1Department of Chemistry, Northwestern University , 2145 Sheridan Road, Evanston, Illinois 60208, United States.

Journal of Chemical Theory and Computation
|July 9, 2016
PubMed

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