Gaussian basis set of sextuple zeta quality for hydrogen through argon

Chemical Physics Letters

Volumn 516, Issue 4-6, 2011, Pages 125-130

  Campos, C T ^a   Ceolin, G A ^a   Canal Neto, A ^a   Jorge, F E ^a   Pansini, F N N ^a  

^a FEDERAL UNIVERSITY OF ESPÍRITO SANTO   (Brazil)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMIZATION ENERGIES; BASIS SETS; CARBON TETRAFLUORIDE; COUPLED CLUSTERS; DOUGLAS-KROLL-HESS HAMILTONIANS; F-FUNCTION; GASEOUS BORON; GAUSSIAN BASIS SETS; HEAT OF FORMATION; POLARIZATION FUNCTIONS; SCALAR-RELATIVISTIC EFFECTS; SPIN-ORBIT EFFECTS; ZETA QUALITY;

ATOMIZATION; BORON; BORON COMPOUNDS; HAMILTONIANS; THERMOCHEMISTRY;

ARGON;

EID: 80655123178     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2011.09.073     Document Type: Article

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