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Correlation between the Stability of Substituted Cobaltocenium and Molecular Descriptors

Journal Article · · Journal of Physical Chemistry. A, Molecules, Spectroscopy, Kinetics, Environment, and General Theory
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  1. Department of Chemistry and Biochemistry, University of South Carolina, Columbia, South Carolina 29208-0001, United States
  2. Department of Mathematics, University of South Carolina, Columbia, South Carolina 29208-0001, United States
+ Show Author Affiliations

Not provided.

Research Organization:
Univ. of South Carolina, Columbia, SC (United States)
Sponsoring Organization:
USDOE Office of Science (SC)
DOE Contract Number:
SC0020272
OSTI ID:
1977956
Journal Information:
Journal of Physical Chemistry. A, Molecules, Spectroscopy, Kinetics, Environment, and General Theory, Vol. 126, Issue 1; ISSN 1089-5639
Publisher:
American Chemical Society
Country of Publication:
United States
Language:
English

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Density‐functional thermochemistry. III. The role of exact exchange journal April 1993
Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density journal January 1988
Dispersion-Corrected Mean-Field Electronic Structure Methods journal April 2016
An improved 6-31G* basis set for first-row transition metals journal May 2003
Cationic Metallo-Polyelectrolytes for Robust Alkaline Anion-Exchange Membranes journal January 2018
Theoretical Study of the Dissociation Energy of First-Row Metallocenium Ions journal July 2014
Where does the electron go? The nature of ortho / para and meta group directing in electrophilic aromatic substitution journal November 2014
XSEDE: Accelerating Scientific Discovery journal September 2014

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