Locality error free effective core potentials for 3d transition metal elements developed for the diffusion Monte Carlo method.
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| Title: | Locality error free effective core potentials for 3d transition metal elements developed for the diffusion Monte Carlo method. |
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| Authors: | Ichibha T; School of Information Science, JAIST, Asahidai 1-1, Nomi, Ishikawa 923-1292, Japan.; Materials Science and Technology Division, Oak Ridge National Laboratory, Oak Ridge, Tennessee 37831, USA., Nikaido Y; School of Information Science, JAIST, Asahidai 1-1, Nomi, Ishikawa 923-1292, Japan., Bennett MC; Materials Science and Technology Division, Oak Ridge National Laboratory, Oak Ridge, Tennessee 37831, USA., Krogel JT; Materials Science and Technology Division, Oak Ridge National Laboratory, Oak Ridge, Tennessee 37831, USA., Hongo K; Research Center for Advanced Computing Infrastructure, JAIST, Asahidai 1-1, Nomi, Ishikawa 923-1292, Japan., Maezono R; School of Information Science, JAIST, Asahidai 1-1, Nomi, Ishikawa 923-1292, Japan., Reboredo FA; Materials Science and Technology Division, Oak Ridge National Laboratory, Oak Ridge, Tennessee 37831, USA. |
| Source: | The Journal of chemical physics [J Chem Phys] 2023 Oct 28; Vol. 159 (16). |
| Publication Type: | Journal Article |
| Journal Info: | Publisher: American Institute of Physics Country of Publication: United States NLM ID: 0375360 Publication Model: Print Cited Medium: Internet ISSN: 1089-7690 (Electronic) Linking ISSN: 00219606 NLM ISO Abbreviation: J Chem Phys Subsets: MEDLINE; PubMed not MEDLINE |
| Database: | MEDLINE Ultimate |
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