Geometry and Electronic Structure of the P-Cluster in Nitrogenase Studied by Combined Quantum Mechanical and Molecular Mechanical Calculations and Quantum Refinement-Reference-Cited by-同舟云学术

Geometry and Electronic Structure of the P-Cluster in Nitrogenase Studied by Combined Quantum Mechanical and Molecular Mechanical Calculations and Quantum Refinement

Published:2019-07-08 Issue:15 Volume:58 Page:9672-9690
ISSN:0020-1669
Container-title:Inorganic Chemistry
language:en
Short-container-title:Inorg. Chem.

Author:

Cao Lili¹,Börner Melanie C.¹²,Bergmann Justin¹,Caldararu Octav¹,Ryde Ulf¹^ORCID

Affiliation:

1. Department of Theoretical Chemistry, Lund University, Chemical Centre, P.O. Box 124, SE-221 00 Lund, Sweden

2. Theoretische Organische Chemie, Organisch-Chemisches Institut and Center for Multiscale Theory and Computation, Westfälische Wilhelms-Universität Münster, Corrensstraße 40, 48149 Münster, Germany

Funder

Vetenskapsr?det

Uppsala Universitet

Lunds Universitet

European Cooperation in Science and Technology

China Scholarship Council

Ume? Universitet

Kungliga Fysiografiska S?llskapet i Lund

Publisher

American Chemical Society (ACS)

Subject

Inorganic Chemistry,Physical and Theoretical Chemistry