Variational wavefunctions and energies for three spin states of Cytochrome P450 Compound I, CAS(25,23)

Variational wavefunctions and energies for "Variational Energies Below the CCSD(T) Reference for P450 Compound I"

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Publication Details

Journal
Zenodo (CERN European Organization for Nuclear Research)
Published
2026-03-21
DOI
https://doi.org/10.5281/zenodo.19140860
Primary Topic
Metal-Catalyzed Oxygenation Mechanisms
Type
article
Field-Weighted Citation Impact
0.00
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article

Variational wavefunctions and energies for three spin states of Cytochrome P450 Compound I, CAS(25,23)

U. Bäcker
Zenodo (CERN European Organization for Nuclear Research)
Metal-Catalyzed Oxygenation Mechanisms
article

Variational wavefunctions and energies for three spin states of Cytochrome P450 Compound I, CAS(25,23)

U. Bäcker
article en

Abstract

Variational wavefunctions and energies for "Variational Energies Below the CCSD(T) Reference for P450 Compound I"

Zenodo (CERN European Organization for Nuclear Research)
Bochum University of Applied Sciences (DE)
Affordable and clean energy
Openalex Percentile: Top 15%
Metal-Catalyzed Oxygenation Mechanisms
DOIOpen Access PDFOpenAlex
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