Computational Investigation of the Metal and Ligand Substitution Effects on the Structure and Electronic States of the Phosphoranimide Tetramer Complexes of Cu(I), Ni(I), Co(I), and Fe(I)

Author:

Spillebout Faustine12,Stoyanov Stanislav R.123ORCID,Zelyak Oleksandr12,Stryker Jeffrey M.4ORCID,Kovalenko Andriy125ORCID

Affiliation:

1. Nanotechnology Research Centre, National Research Council of Canada, 11421 Saskatchewan Drive, Edmonton, Alberta T6G 2M9, Canada

2. Department of Mechanical Engineering, University of Alberta, 10-203 Donadeo Innovation Centre for Engineering, Edmonton, Alberta T6G 1H9, Canada

3. Natural Resources Canada, CanmetENERGY Devon, 1 Oil Patch Drive, Devon, Alberta T9G 1A8, Canada

4. Department of Chemistry, University of Alberta, Edmonton, Alberta T6G 2G2, Canada

5. Department of Biological Sciences, University of Alberta, CW 405, Biological Sciences Building, Edmonton, Alberta T6G 2E9, Canada

Funder

Office of Energy Research and Development

Natural Sciences and Engineering Research Council of Canada

Centre for Oil Sand Innovation

Institute for Oil Sand Innovation, University of Alberta

Publisher

American Chemical Society (ACS)

Subject

Inorganic Chemistry,Physical and Theoretical Chemistry

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