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The initial implementation and applications of a general active space coupled cluster method

✍ Scribed by Olsen, Jeppe


Book ID
121505688
Publisher
American Institute of Physics
Year
2000
Tongue
English
Weight
253 KB
Volume
113
Category
Article
ISSN
0021-9606

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πŸ“œ SIMILAR VOLUMES


Complete active space coupled-cluster me
✍ Leszek Z. Stolarczyk πŸ“‚ Article πŸ“… 1994 πŸ› Elsevier Science 🌐 English βš– 471 KB

It is proposed that the calculation of non-dynamical electronic correlation effects by the complete active space self-consistent field (CASSCF) method can be extended by the inclusion of dynamical correlation effects through the use of a suitably modified single-reference coupled-cluster (CC) proced