Pseudopotential-Based Correlation Consistent Composite Approach (rp-ccCA) for First- and Second-Row Transition Metal Thermochemistry-Reference-Cited by-同舟云学术

Pseudopotential-Based Correlation Consistent Composite Approach (rp-ccCA) for First- and Second-Row Transition Metal Thermochemistry

Published:2015-06-05 Issue:26 Volume:119 Page:6867-6874
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Manivasagam Sivabalan¹,Laury Marie L.¹,Wilson Angela K.¹

Affiliation:

1. Department of Chemistry and Center for Advanced Scientific Computing and Modeling, University of North Texas, Denton, Texas 76203-5017, United States

Funder

Division of Chemistry

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.5b02433

Reference80 articles.

1. Highly efficient molybdenum-based catalysts for enantioselective alkene metathesis

2. Large-Scale Applications of Transition Metal-Catalyzed Couplings for the Synthesis of Pharmaceuticals

3. C−C Bond Formation via C−H Bond Activation Using an in Situ-Generated Ruthenium Catalyst

4. Direct and Selective Arylation of Tertiary Silanes with Rhodium Catalyst

5. Gas phase catalysis by zeolites

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