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Revisiting the Fundamental Nature of Metal‐Ligand Bonding: An Impartial and Automated Fitting Procedure for Angular Overlap Model Parameters

Buchhorn, Moritz ; Deeth, Robert J. ; Krewald, Vera (2022):
Revisiting the Fundamental Nature of Metal‐Ligand Bonding: An Impartial and Automated Fitting Procedure for Angular Overlap Model Parameters.
In: Chemistry – A European Journal, 2022, pp. 1-32. Wiley-Blackwell - STM, ISSN 0947-6539,
DOI: 10.1002/chem.202103775,
[Article]

Item Type: Article
Erschienen: 2022
Creators: Buchhorn, Moritz ; Deeth, Robert J. ; Krewald, Vera
Title: Revisiting the Fundamental Nature of Metal‐Ligand Bonding: An Impartial and Automated Fitting Procedure for Angular Overlap Model Parameters
Language: English
Journal or Publication Title: Chemistry – A European Journal
Volume of the journal: 2022
Publisher: Wiley-Blackwell - STM
Divisions: DFG-Collaborative Research Centres (incl. Transregio)
DFG-Collaborative Research Centres (incl. Transregio) > Collaborative Research Centres
07 Department of Chemistry
Zentrale Einrichtungen
Zentrale Einrichtungen > University IT-Service and Computing Centre (HRZ)
Zentrale Einrichtungen > University IT-Service and Computing Centre (HRZ) > Hochleistungsrechner
DFG-Collaborative Research Centres (incl. Transregio) > Collaborative Research Centres > CRC 1487: Iron, upgraded!
07 Department of Chemistry > Theoretische Chemie
Date Deposited: 05 Jan 2022 07:12
DOI: 10.1002/chem.202103775
URL / URN: https://chemistry-europe.onlinelibrary.wiley.com/doi/10.1002...
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Paper e202103775

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