. "Stabilisation energies of stacked structures of C6H6...C6X6 (X = F, Cl, Br, I, CN) complexes were determined at the CCSD(T) complete basis set limit level. They are considerably larger than those calculated previously. Pseudopotential based calculations show, that due to relativistic effects hexaiodobenzene is less stable than hexabromobenzene. The SAPT decomposition of interaction energy into its components shows, that dispersion is the main stabilizing contribution."@en . "Stabiliza\u010Dn\u00ED energie komplex\u016F C6H6...C6X6 (X = F, Cl, Br, I, CN): v\u00FDpo\u010Dty s \u00FAplnou b\u00E1zovou limitou na \u00FArovn\u00EDch MP2 a CCSD(T)"@cs . "RIV/61388963:_____/07:00081641!RIV07-AV0-61388963" . "[7B7081EF012B]" . "Jure\u010Dka, P." . . "Hobza, Pavel" . "Stabiliza\u010Dn\u00ED energie komplex\u016F C6H6...C6X6 (X = F, Cl, Br, I, CN): v\u00FDpo\u010Dty s \u00FAplnou b\u00E1zovou limitou na \u00FArovn\u00EDch MP2 a CCSD(T)"@cs . . "6" . "Metodami MP2 a CCSD(T) byly vypo\u010Dteny limity stabiliza\u010Dn\u00ED energie v \u00FApln\u00E9 b\u00E1zi pro komplexy C6H6...C6X6 (X = F, Cl, Br, I, CN). Ty jsou daleko v\u011Bt\u0161\u00ED, ne\u017E dosud publikovan\u00E9 vypo\u010Dten\u00E9 hodnoty. V\u00FDpo\u010Dty s pseudopotenci\u00E1ly ukazuj\u00ED, \u017Ee d\u00EDky relativistick\u00FDm efekt\u016Fm je stabiliza\u010Dn\u00ED energie hexaiodobenzenu men\u0161\u00ED, ne\u017E u hexabromobenzenu. Byla provedena t\u00E9\u017E dekompozice interak\u010Dn\u00ED energie na jednotliv\u00E9 slo\u017Eky metodou SAPT. Hlavn\u00EDm p\u0159\u00EDsp\u011Bvkem ke stabilizaci komplex\u016F je podle SAPT v\u00FDpo\u010Dtu disperzn\u00ED energie."@cs . . . . "Stabilisation energy of C6H6 ... C6X6 (X = F, Cl, Br, I, CN) complexes: complete basis set limit calculations at MP2 and CCSD(T) levels" . "GB - Spojen\u00E9 kr\u00E1lovstv\u00ED Velk\u00E9 Brit\u00E1nie a Severn\u00EDho Irska" . "Stabilisation energy of C6H6 ... C6X6 (X = F, Cl, Br, I, CN) complexes: complete basis set limit calculations at MP2 and CCSD(T) levels"@en . "RIV/61388963:_____/07:00081641" . . . . . . "1463-9076" . "Stabilisation energy of C6H6 ... C6X6 (X = F, Cl, Br, I, CN) complexes: complete basis set limit calculations at MP2 and CCSD(T) levels"@en . "P(GA203/05/0009), P(LC512), Z(AV0Z40550506), Z(MSM6198959216)" . . . . . . . . "451986" . . "9" . "dispersion interaction; benzene dimer; interaction energy decomposition"@en . "3"^^ . "Stabilisation energies of stacked structures of C6H6...C6X6 (X = F, Cl, Br, I, CN) complexes were determined at the CCSD(T) complete basis set limit level. They are considerably larger than those calculated previously. Pseudopotential based calculations show, that due to relativistic effects hexaiodobenzene is less stable than hexabromobenzene. The SAPT decomposition of interaction energy into its components shows, that dispersion is the main stabilizing contribution." . "Pluh\u00E1\u010Dkov\u00E1, Krist\u00FDna" . "Stabilisation energy of C6H6 ... C6X6 (X = F, Cl, Br, I, CN) complexes: complete basis set limit calculations at MP2 and CCSD(T) levels" . "6"^^ . . "Physical Chemistry Chemical Physics" . "2"^^ . "755;760" .