FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2001342670> ?p ?o ?g. }

• W2001342670 endingPage "140" @default.
• W2001342670 startingPage "133" @default.
• W2001342670 abstract "Abstract The single reference coupled cluster based linear response theory (CCLRT) and valence-universal multi-reference coupled cluster (VU-MRCC) theory for direct difference energy calculations have been presented. The similarities and differences in the structure of these two formalisms have also been addressed. The core-extensive CCLRT is applied to compute the ionization potentials (IPs) of HCl and excitation energies of CuH using Hartree–Fock (HF) orbitals. We further report the relativistic applications of the VU-MRCC theory through the computation of the ground and excited/ionized state energies and related properties of Ag and Hg atoms using Dirac–Hartree–Fock (DHF) orbitals. The IPs, excitation energies, and the spectroscopic constants reported here are in favorable agreement with experiment and with other correlated calculations." @default.
• W2001342670 created "2016-06-24" @default.
• W2001342670 creator A5029143611 @default.
• W2001342670 creator A5040085033 @default.
• W2001342670 creator A5051645401 @default.
• W2001342670 creator A5085692539 @default.
• W2001342670 date "2006-08-01" @default.
• W2001342670 modified "2023-09-26" @default.
• W2001342670 title "Applications of core-valence extensive multi-reference coupled cluster theory and core-extensive coupled cluster-based linear response theory" @default.
• W2001342670 cites W1519575691 @default.
• W2001342670 cites W1532595750 @default.
• W2001342670 cites W1550228429 @default.
• W2001342670 cites W1655040123 @default.
• W2001342670 cites W1661614528 @default.
• W2001342670 cites W1963551315 @default.
• W2001342670 cites W1964344090 @default.
• W2001342670 cites W1967607007 @default.
• W2001342670 cites W1968731485 @default.
• W2001342670 cites W1971136067 @default.
• W2001342670 cites W1971575735 @default.
• W2001342670 cites W1974518136 @default.
• W2001342670 cites W1975270191 @default.
• W2001342670 cites W1976376961 @default.
• W2001342670 cites W1980726836 @default.
• W2001342670 cites W1980780902 @default.
• W2001342670 cites W1980857195 @default.
• W2001342670 cites W1981492006 @default.
• W2001342670 cites W1987145285 @default.
• W2001342670 cites W1988720980 @default.
• W2001342670 cites W1993484621 @default.
• W2001342670 cites W1997041494 @default.
• W2001342670 cites W1997103302 @default.
• W2001342670 cites W1997900942 @default.
• W2001342670 cites W1998402626 @default.
• W2001342670 cites W2002136029 @default.
• W2001342670 cites W2003280920 @default.
• W2001342670 cites W2004546742 @default.
• W2001342670 cites W2005600192 @default.
• W2001342670 cites W2009301349 @default.
• W2001342670 cites W2011029504 @default.
• W2001342670 cites W2012507958 @default.
• W2001342670 cites W2012868161 @default.
• W2001342670 cites W2016227906 @default.
• W2001342670 cites W2019425390 @default.
• W2001342670 cites W2019459231 @default.
• W2001342670 cites W2019667449 @default.
• W2001342670 cites W2019923061 @default.
• W2001342670 cites W2020926389 @default.
• W2001342670 cites W2021908552 @default.
• W2001342670 cites W2024324223 @default.
• W2001342670 cites W2025105698 @default.
• W2001342670 cites W2025876795 @default.
• W2001342670 cites W2028974637 @default.
• W2001342670 cites W2029721189 @default.
• W2001342670 cites W2031159359 @default.
• W2001342670 cites W2033305027 @default.
• W2001342670 cites W2033422372 @default.
• W2001342670 cites W2033461475 @default.
• W2001342670 cites W2036118309 @default.
• W2001342670 cites W2037771801 @default.
• W2001342670 cites W2042300609 @default.
• W2001342670 cites W2044102935 @default.
• W2001342670 cites W2046090794 @default.
• W2001342670 cites W2050621686 @default.
• W2001342670 cites W2057949572 @default.
• W2001342670 cites W2061226253 @default.
• W2001342670 cites W2062340785 @default.
• W2001342670 cites W2064261312 @default.
• W2001342670 cites W2065379390 @default.
• W2001342670 cites W2066481445 @default.
• W2001342670 cites W2068185853 @default.
• W2001342670 cites W2068855384 @default.
• W2001342670 cites W2069327909 @default.
• W2001342670 cites W2069660763 @default.
• W2001342670 cites W2076280753 @default.
• W2001342670 cites W2077964984 @default.
• W2001342670 cites W2079227079 @default.
• W2001342670 cites W2080670740 @default.
• W2001342670 cites W2082369089 @default.
• W2001342670 cites W2083288055 @default.
• W2001342670 cites W2085890322 @default.
• W2001342670 cites W2086836197 @default.
• W2001342670 cites W2088241493 @default.
• W2001342670 cites W2092422978 @default.
• W2001342670 cites W2093169410 @default.
• W2001342670 cites W2093690886 @default.
• W2001342670 cites W2093993629 @default.
• W2001342670 cites W2095306992 @default.
• W2001342670 cites W2096509967 @default.
• W2001342670 cites W2109931506 @default.
• W2001342670 cites W2118047751 @default.
• W2001342670 cites W2121686792 @default.
• W2001342670 cites W2122826812 @default.
• W2001342670 cites W2145582959 @default.
• W2001342670 cites W2177252302 @default.
• W2001342670 cites W4240035468 @default.
• W2001342670 doi "https://doi.org/10.1016/j.theochem.2006.05.015" @default.
• W2001342670 hasPublicationYear "2006" @default.

• next