Natural orbital functional description of van der waals interactions. A case study of the effect of the basis set for the helium dimer

International Journal of Quantum Chemistry

Volumn 108, Issue 10, 2008, Pages 1660-1663

  Piris, Mario ^a   Lopez, Xabier ^a   Ugalde, Jesus M ^a  

^a UNIVERSITY OF THE BASQUE COUNTRY UPV EHU   (Spain)

Author keywords

Helium dimer; NOFT; PNOF; RDMT; Van der waals

Indexed keywords

ALUMINUM; BINDING ENERGY; FLOW INTERACTIONS; HELIUM; INERT GASES; NUCLEAR PHYSICS; NUMBER THEORY; NUMERICAL ANALYSIS; POTENTIAL ENERGY; RADIOACTIVITY; ROCKETS; TRUCKS; VAN DER WAALS FORCES;

(MIN ,MAX ,+) FUNCTIONS; BASIS SETS; CASE STUDIES; CORRELATION CONSISTENT POLARIZED VALENCE; EQUILIBRIUM DISTANCES; NATURAL ORBITAL FUNCTIONAL; POTENTIAL ENERGY CURVES; VAN DER WAALS (VDW) INTERACTIONS;

SET THEORY;

EID: 45749086161     PISSN: 00207608     EISSN: 1097461X     Source Type: Journal    
DOI: 10.1002/qua.21572     Document Type: Conference Paper

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