"[9E1061BC9BC8]" . . . "CCSD(T), harmonic frequencies, dissociation energies, diatomic molecules"@en . "To determine ground state bond length and harmonic vibrational frequencies of S2, NF and NS as well as their negatively and positively charged ions, the sophisticated CCSD(T) approach was used. The obtained energies were extrapolated to CBS limit using correlation consistent basis set from DZ to 5Z extent. Furthermore, at this level of theory the dissociation energies were determined." . "2"^^ . . "NL - Nizozemsko" . "26220" . . "Na ur\u010Den\u00ED rovnov\u00E1\u017En\u00FDch vazebn\u00FDch d\u00E9lek a harmonick\u00FDch vibra\u010Dn\u00EDch frekvenc\u00ED S-2, NF, NS a jejich positivn\u011B a negativn\u011B nabit\u00FDch iont\u016F byl pou\u017Eit n\u00E1ro\u010Dn\u00FD p\u0159\u00EDstup CCSD(T). Z\u00EDskan\u00E9 hodnoty energi\u00ED byly extrapolov\u00E1ny k limit\u011B CBS po\u017Eit\u00EDm korela\u010Dn\u011B konsistentn\u00ED b\u00E1ze v rozsahu DZ a\u017E 5Z. Na t\u00E9to \u00FArovni teorie byly d\u00E1le ur\u010Deny disocia\u010Dn\u00ED energie."@cs . . . . . "2"^^ . "0301-0104" . . "6"^^ . "RIV/00216305:26220/04:PU62899!RIV08-GA0-26220___" . . . "556950" . . "CCSD(T) v\u00FDpo\u010Det rovnov\u00E1\u017En\u00FDch geometri\u00ED a spektroskopick\u00FDch konstant S-2, NF, NS a jejich iont\u016F"@cs . "Chemical Physics" . "RIV/00216305:26220/04:PU62899" . "CCSD(T) calculations of equilibrium geometries and spectroscopic constants for the diatomics S-2, NF, NS, and their ions" . "\u017Divn\u00FD, Old\u0159ich" . "CCSD(T) calculations of equilibrium geometries and spectroscopic constants for the diatomics S-2, NF, NS, and their ions" . "1-3" . . "CCSD(T) calculations of equilibrium geometries and spectroscopic constants for the diatomics S-2, NF, NS, and their ions"@en . . "P(GA102/02/1414), P(KSK4050111), Z(AV0Z4050913)" . "303" . . . . "Czernek, Ji\u0159\u00ED" . . . "CCSD(T) v\u00FDpo\u010Det rovnov\u00E1\u017En\u00FDch geometri\u00ED a spektroskopick\u00FDch konstant S-2, NF, NS a jejich iont\u016F"@cs . "To determine ground state bond length and harmonic vibrational frequencies of S2, NF and NS as well as their negatively and positively charged ions, the sophisticated CCSD(T) approach was used. The obtained energies were extrapolated to CBS limit using correlation consistent basis set from DZ to 5Z extent. Furthermore, at this level of theory the dissociation energies were determined."@en . "CCSD(T) calculations of equilibrium geometries and spectroscopic constants for the diatomics S-2, NF, NS, and their ions"@en . "137-142" . .