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Higher-order explicitly correlated coupled-cluster methods.
Shiozaki T, Kamiya M, Hirata S, Valeev EF. Shiozaki T, et al. Among authors: hirata s. J Chem Phys. 2009 Feb 7;130(5):054101. doi: 10.1063/1.3068302. J Chem Phys. 2009. PMID: 19206952
Combining these CC-R12 methods with the grid-based, numerical Hartree-Fock equation solver [T. Shiozaki and S. Hirata, Phys. Rev. A 76, 040503(R) (2007)], the solutions (eigenvalues) of the Schrodinger equations of neon, boron hydride, hydrogen fluoride, and water a …
Combining these CC-R12 methods with the grid-based, numerical Hartree-Fock equation solver [T. Shiozaki and S. Hirata, Phys. R …
1,080 results