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A DMRG/CASPT2 Investigation of Metallocorroles: Quantifying Ligand Noninnocence in Archetypal 3d and 4d Element Derivatives
Author(s) -
Quan Manh Phung,
Yasin Muchammad,
Takeshi Yanai,
Abhik Ghosh
Publication year - 2021
Publication title -
jacs au
Language(s) - English
Resource type - Journals
ISSN - 2691-3704
DOI - 10.1021/jacsau.1c00417
Subject(s) - ligand (biochemistry) , element (criminal law) , chemistry , computer science , political science , biochemistry , receptor , law

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