Performance of Density Functionals for Activation Energies of Re-Catalyzed Organic Reactions-Reference-Cited by-同舟云学术

Performance of Density Functionals for Activation Energies of Re-Catalyzed Organic Reactions

Published:2014-01-07 Issue:2 Volume:10 Page:579-588
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Sun Yihua¹,Chen Hui¹

Affiliation:

1. Beijing National Laboratory for Molecular Sciences (BNLMS), CAS Key Laboratory of Photochemistry, Institute of Chemistry, Chinese Academy of Sciences, Beijing, 100190, China

Funder

National Natural Science Foundation of China

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/ct4010855

Reference139 articles.

1. Organic Reactions Catalyzed by Rhenium Carbonyl Complexes

2. Recent Development of Rhenium-Catalyzed Organic Synthesis

3. aBoag, N. M.; Kaesz, H. D.Comprehensive Organometallic Chemistry;Wilkinson, G.; Stone, F. G. A.; Abel, E. W., Eds.Pergamon Press:Oxford, U.K., 1982; Vol.4, pp161–242.

4. bO’Connor, J. M.Comprehensive Organometallic Chemistry II;Abel, E. W.; Stone, F. G. A.; Wilkinson, G., Eds.Pergamon Press:Oxford, U.K., 1995; Vol.6, pp167–229.

5. cHoffman, D. M.Comprehensive Organometallic Chemistry II;Abel, E. W.; Stone, F. G. A.; Wilkinson, G., Eds.Pergamon Press:Oxford, U.K., 1995; Vol.6, pp231–255.

Cited by 45 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Quantum Chemistry of d- and f-Block Elements;Comprehensive Computational Chemistry;2024

2. Dispersion-corrected r2SCAN based double-hybrid functionals;The Journal of Chemical Physics;2023-12-08

3. Assessment of DLPNO-MP2 Approximations in Double-Hybrid DFT;Journal of Chemical Theory and Computation;2023-10-20

4. The Good, the Bad, and the Ugly: Pseudopotential Inconsistency Errors in Molecular Applications of Density Functional Theory;Journal of Chemical Theory and Computation;2023-05-08

5. Optimization of the r²SCAN-3c Composite Electronic-Structure Method for Use with Slater-Type Orbital Basis Sets;The Journal of Physical Chemistry A;2022-06-02