Benchmarks for Electronically Excited States: A Comparison of Noniterative and 
Iterative Triples Corrections in Linear Response Coupled Cluster Methods: 
CCSDR(3) versus CC3

Sauer, S. P. A.; Schreiber, M.; Ramos da Silva, M.; Thiel, W.

doi:10.1021/ct800256j

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Benchmarks for Electronically Excited States: A Comparison of Noniterative and Iterative Triples Corrections in Linear Response Coupled Cluster Methods: CCSDR(3) versus CC3

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Sauer, S. P. A.
Research Department Thiel, Max-Planck-Institut für Kohlenforschung, Max Planck Society;
Research Department Thiel, Max-Planck-Institut für Kohlenforschung, Max Planck Society;

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Schreiber, M.
Research Department Thiel, Max-Planck-Institut für Kohlenforschung, Max Planck Society;
Research Department Thiel, Max-Planck-Institut für Kohlenforschung, Max Planck Society;

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Ramos da Silva, M.
Research Department Thiel, Max-Planck-Institut für Kohlenforschung, Max Planck Society;
Research Department Thiel, Max-Planck-Institut für Kohlenforschung, Max Planck Society;
Research Department Thiel, Max-Planck-Institut für Kohlenforschung, Max Planck Society;

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Thiel, W.
Research Department Thiel, Max-Planck-Institut für Kohlenforschung, Max Planck Society;
Research Department Thiel, Max-Planck-Institut für Kohlenforschung, Max Planck Society;

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Sauer, S. P. A., Schreiber, M., Ramos da Silva, M., & Thiel, W. (2009). Benchmarks for Electronically Excited States: A Comparison of Noniterative and Iterative Triples Corrections in Linear Response Coupled Cluster Methods: CCSDR(3) versus CC3. Journal of Chemical Theory and Computation, 5, 555-564. doi:10.1021/ct800256j.

引用: https://hdl.handle.net/11858/00-001M-0000-000F-8EDD-A

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