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- W3100605501 endingPage "1366" @default.
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- W3100605501 abstract "Accurate quartic anharmonic force fields for CF4 and SiF4 have been calculated using the CCSD(T) method and basis sets of spdf quality. Based on the ab initio force field with a minor empirical adjustment, the vibrational energy levels of these two molecules and their isotopomers are calculated by means of high order Canonical Van Vleck Perturbation Theory (CVPT) based on curvilinear coordinates. The calculated energies agree very well with the experimental data. The full quadratic force field of CF4 is further refined to the experimental data. The symmetrization of the Cartesian basis for arbitrary combination bands of Td group molecules is discussed using the circular promotion operator for the doubly degenerate modes, together with tabulated vector coupling coefficients. The extraction of the spectroscopic constants from our second order transformed Hamiltonian in curvilinear coordinates is discussed, and compared to a similar procedure in rectilinear coordinates." @default.
- W3100605501 created "2020-11-23" @default.
- W3100605501 creator A5015331508 @default.
- W3100605501 creator A5030243146 @default.
- W3100605501 creator A5079410647 @default.
- W3100605501 date "2000-01-15" @default.
- W3100605501 modified "2023-10-06" @default.
- W3100605501 title "Anharmonic force field and vibrational frequencies of tetrafluoromethane (CF4) and tetrafluorosilane (SiF4)" @default.
- W3100605501 cites W1615636617 @default.
- W3100605501 cites W1666009189 @default.
- W3100605501 cites W1976022856 @default.
- W3100605501 cites W1976423414 @default.
- W3100605501 cites W1978742981 @default.
- W3100605501 cites W1979648878 @default.
- W3100605501 cites W1982222649 @default.
- W3100605501 cites W1982748552 @default.
- W3100605501 cites W1983812510 @default.
- W3100605501 cites W1985470224 @default.
- W3100605501 cites W1985510828 @default.
- W3100605501 cites W1986499685 @default.
- W3100605501 cites W1988381051 @default.
- W3100605501 cites W1990907451 @default.
- W3100605501 cites W1991561888 @default.
- W3100605501 cites W1992237429 @default.
- W3100605501 cites W1993077801 @default.
- W3100605501 cites W1997092688 @default.
- W3100605501 cites W1997115013 @default.
- W3100605501 cites W1997897452 @default.
- W3100605501 cites W1998079827 @default.
- W3100605501 cites W1998716773 @default.
- W3100605501 cites W2005367293 @default.
- W3100605501 cites W2007100348 @default.
- W3100605501 cites W2008363502 @default.
- W3100605501 cites W2012458244 @default.
- W3100605501 cites W2014000125 @default.
- W3100605501 cites W2016103277 @default.
- W3100605501 cites W2018937156 @default.
- W3100605501 cites W2022359844 @default.
- W3100605501 cites W2023343549 @default.
- W3100605501 cites W2025607662 @default.
- W3100605501 cites W2026536680 @default.
- W3100605501 cites W2027776883 @default.
- W3100605501 cites W2027822530 @default.
- W3100605501 cites W2027860420 @default.
- W3100605501 cites W2027918221 @default.
- W3100605501 cites W2034417594 @default.
- W3100605501 cites W2034963796 @default.
- W3100605501 cites W2035096164 @default.
- W3100605501 cites W2036034048 @default.
- W3100605501 cites W2036741276 @default.
- W3100605501 cites W2037349653 @default.
- W3100605501 cites W2041900233 @default.
- W3100605501 cites W2043087330 @default.
- W3100605501 cites W2047068336 @default.
- W3100605501 cites W2049674603 @default.
- W3100605501 cites W2050087869 @default.
- W3100605501 cites W2052157111 @default.
- W3100605501 cites W2054214646 @default.
- W3100605501 cites W2055968379 @default.
- W3100605501 cites W2055976649 @default.
- W3100605501 cites W2057785791 @default.
- W3100605501 cites W2057911988 @default.
- W3100605501 cites W2059051867 @default.
- W3100605501 cites W2062772754 @default.
- W3100605501 cites W2063741707 @default.
- W3100605501 cites W2064360119 @default.
- W3100605501 cites W2064818050 @default.
- W3100605501 cites W2065798038 @default.
- W3100605501 cites W2068371756 @default.
- W3100605501 cites W2069006374 @default.
- W3100605501 cites W2073058770 @default.
- W3100605501 cites W2073984929 @default.
- W3100605501 cites W2074031585 @default.
- W3100605501 cites W2074772317 @default.
- W3100605501 cites W2078943997 @default.
- W3100605501 cites W2079416088 @default.
- W3100605501 cites W2083980826 @default.
- W3100605501 cites W2084105968 @default.
- W3100605501 cites W2084383634 @default.
- W3100605501 cites W2088043843 @default.
- W3100605501 cites W2088539530 @default.
- W3100605501 cites W2088843566 @default.
- W3100605501 cites W2092930273 @default.
- W3100605501 cites W2101629414 @default.
- W3100605501 cites W2115310355 @default.
- W3100605501 cites W2122284044 @default.
- W3100605501 cites W2123078913 @default.
- W3100605501 cites W2128696722 @default.
- W3100605501 cites W2140772159 @default.
- W3100605501 cites W2286994528 @default.
- W3100605501 cites W2299437394 @default.
- W3100605501 cites W4240035468 @default.
- W3100605501 cites W4243524177 @default.
- W3100605501 doi "https://doi.org/10.1063/1.481590" @default.
- W3100605501 hasPublicationYear "2000" @default.
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