An accurate ab initio calculation of the He2 potential curve

Chemical Physics Letters

Volumn 143, Issue 5, 1988, Pages 435-438

  Van Lenthe, J H ^a   Vos, R J ^a   Van Duijneveldt Van De Rijdt, J G C M ^a   Van Duijneveldt, F B ^a  

^a UTRECHT UNIVERSITY   (Netherlands)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0010681736     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/0009-2614(88)87391-3     Document Type: Article

References (29)

1. Ab initio potential curve for Be2(1Σg+) from the interacting correlated fragments method
2. Extensive theoretical studies of the hydrogen-bonded complexes (H2O)2, (H2O)2H+, (HF)2, (HF)2H+, F2H−, and (NH3)2
3. Proper correction for the basis set superposition error in SCF calculations of intermolecular interactions
4. A CEPA2 investigation of the He-He and He-Li+potential functions
5. Präzisionsmessungen des Viskositätskoeffizienten von Stickstoff und den Edelgasen zwischen Raumtemperatur und 650 K
6. A new determination of the ground state interatomic potential for He2
7. Accurate calculation of the attractive interaction of two ground state helium atoms
8. The calculation of small molecular interactions by the differences of separate total energies. Some procedures with reduced errors
9. Correction of the basis set superposition error in SCF and MP2 interaction energies. The water dimer
10. Dimer centred basis set in the calculations of the first-order interaction energy with CI wavefunction
11. The direct CI method
12. A semi-empiricalMO theory for ionization potentials and electron affinities
13. Analysis of intra-atomic correlation effects on the first order interaction energy between He atoms