Comment on 'Canonical transcorrelated theory with projected Slater-type geminals' [J. Chem. Phys. 136, 084107 (2012)]
| Autor: | Masteran, Conner, Kumar, Ashutosh, Teke, Nakul, Gaudel, Bimal, Yanai, Takeshi, Valeev, Edward F. |
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| Rok vydání: | 2022 |
| Předmět: | |
| Druh dokumentu: | Working Paper |
| DOI: | 10.1063/5.0135257 |
| Popis: | This Comment identifies errors in the formalism/implementation reported in Ref. 1 and discusses some aspects of that work that were not fully specified in the original publication. This Comment also provides reference numerical results for a simple system to ease future implementation of the approach by other researchers. Comment: 3 pages |
| Databáze: | arXiv |
| Externí odkaz: |
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