Dataset
Supporting Data: Structural and Theoretical Assessment of Covalency in a Pu(III) Borohydride Complex
figshare
09/11/2024
DOI: 10.6084/m9.figshare.26997388
Abstract
Supporting computational data for the publication titled:J. C. Zgrabik, D. J. Lussier, R. Bhowmick, N. Nguyen, P. A. Zacher III, T. Elkin,* A. J. Gaunt,* G. S. Goff, H. E. Mason, J. Murillo, B. L. Scott, B. Vlaisavljevich, and S. R. Daly* “Structural and Theoretical Assessment of Covalency in a Pu(III) Borohydride Complex", J. Am. Chem. Soc., 2024. DOI: 10.1021/jacs.4c09888
Details
- Title: Subtitle
- Supporting Data: Structural and Theoretical Assessment of Covalency in a Pu(III) Borohydride Complex
- Creators
- Bess VlaisavljevichRina BhowmickNgan Nguyen
- Resource Type
- Dataset
- DOI
- 10.6084/m9.figshare.26997388
- Publisher
- figshare
- Grant note
- CASPT2 Geometries, Spectra, and Relativistic Electronic Structures of Actinide Species - DE-SC0023022 / Office of Basic Energy Sciences (https://ror.org/05mg91w61)
- Language
- English
- Date published
- 09/11/2024
- Academic Unit
- Chemistry
- Record Identifier
- 9984708949302771
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