Development of Accurate DFT Methods for Computing Redox Potentials of Transition Metal Complexes: Results for Model Complexes and Application to Cytochrome P450

Title
Development of Accurate DFT Methods for Computing Redox Potentials of Transition Metal Complexes: Results for Model Complexes and Application to Cytochrome P450
Authors
Keywords
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Journal
Journal of Chemical Theory and Computation
Volume 8, Issue 2, Pages 442-459
Publisher
American Chemical Society (ACS)
Online
2012-01-14
DOI
10.1021/ct2006693

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