WebLastly, we discuss an explicitly correlated formalism for the second-order single-particle Green’s function method (GF2-F12) that does not assume the popular diagonal approxi … WebMay 6, 2013 · The variational method complemented with the use of explicitly correlated Gaussian basis functions is one of the most powerful approaches currently used for calculating the properties of few-body systems. Despite its conceptual simplicity, the method offers great flexibility, high accuracy, and can be used to study diverse quantum …
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WebDec 26, 2024 · The S66 noncovalent interactions benchmark reconsidered using explicitly correlated methods near the basis set limit Manoj K. Kesharwani, Amir Karton, Nitai Sylvetsky, Jan M.L. Martin The S66 benchmark for noncovalent interactions has been re-evaluated using explicitly correlated methods with basis sets near the one-particle … WebNov 13, 2008 · Explicitly correlated energies for neutral atoms and cations with 37 ⩽ Z ⩽ 54 Semantic Scholar DOI: 10.1016/J.CPLETT.2008.10.019 Corpus ID: 96666796 Explicitly correlated energies for neutral atoms and cations with 37 ⩽ Z ⩽ 54 E. Buend́ıa, F. J. Gálvez, A. Sarsa Published 13 November 2008 Physics Chemical Physics Letters … jerome powell speaking time tomorrow
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WebJan 29, 2024 · Hill, S. Mazumder, and K. A. Peterson, “ Correlation consistent basis sets for molecular core-valence effects with explicitly correlated wave functions: The atoms B–Ne and Al–Ar,” J. Chem. Phys. 132, 054108 (2010). WebFeb 5, 2013 · The parameters of the explicitly correlated function were determined variationally at each field strength. The scaling of total exciton energy, exciton binding energy, and electron-hole recombination probability with respect to the strength of the electric field was investigated. It was found that a 500 kV/cm change in field strength … Web212 other terms for be explicitly related- words and phrases with similar meaning pack of carrots