Accurate atomization energies from combining coupled-cluster computations with interference-corrected explicitly correlated second-order perturbation theory-Reference-Cited by-同舟云学术

Accurate atomization energies from combining coupled-cluster computations with interference-corrected explicitly correlated second-order perturbation theory

Published:2014-01-30 Issue:3 Volume:133 Page:
ISSN:1432-881X
Container-title:Theoretical Chemistry Accounts
language:en
Short-container-title:Theor Chem Acc

Author:

Vogiatzis Konstantinos D.,Haunschild Robin,Klopper Wim

Publisher

Springer Science and Business Media LLC

Subject

Physical and Theoretical Chemistry

Link

http://link.springer.com/content/pdf/10.1007/s00214-014-1446-0.pdf

Reference73 articles.

1. Peterson KA, Dunning TH Jr (1995) J Phys Chem 99:3898–3901

2. Dunning TH Jr (2000) J Phys Chem A 104:9062–9080

3. Dunning TH Jr (1989) J Chem Phys 90:1007–1024

4. Klopper W, Bachorz RA, Hättig C, Tew DP (2010) Theor Chem Acc 126:289–304

5. Hättig C, Klopper W, Köhn A, Tew DP (2012) Chem Rev 112:4–74

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