Electronic structure calculations on workstation computers: The program system turbomole

Chemical Physics Letters

Volumn 162, Issue 3, 1989, Pages 165-169

  Ahlrichs, Reinhart ^a   Bär, Michael ^a   Häser, Marco ^a   Horn, Hans ^a   Kölmel, Christoph ^a  

^a UNIVERSITY OF KARLSRUHE   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 4243539377     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/0009-2614(89)85118-8     Document Type: Article

References (17)

1. Principles for a directSCF approach toLICAO-MOab-initio calculations
2. Improvements on the direct SCF method
3. Efficient recursive computation of molecular integrals over Cartesian Gaussian functions
4. Computation of electron repulsion integrals using the rys quadrature method