On the computation of (2-2) three-center Slater-type orbital integrals of l/r 12 using Fourier-transform-based analytical formulas

International Journal of Quantum Chemistry

Volumn 100, Issue 2 SPEC. ISS., 2004, Pages 146-154

  Antolovic, Danko ^a   Silverstone, Harris J ^b  

^a INDIANA UNIVERSITY   (United States)

^b JOHNS HOPKINS UNIVERSITY   (United States)

Author keywords

Exponential orbital integrals; Multicenter integrals; Slater type orbital integrals; Three center integrals

Indexed keywords

EXPONENTIAL ORBITAL INTEGRALS; MULTICENTER INTEGRAL; SLATER-TYPE ORBITAL INTEGRALS; THREE-CENTER INTEGRALS;

ASYMPTOTIC STABILITY; FUNCTIONS; INTEGRAL EQUATIONS; MATHEMATICAL MODELS; THEOREM PROVING; VECTORS;

FOURIER TRANSFORMS;

EID: 6344243195     PISSN: 00207608     EISSN: None     Source Type: Journal    
DOI: 10.1002/qua.20123     Document Type: Article

References (26)

1. Safouhi, H.; Hoggan, P. E. J Phys A 1998, 31, 8941.
2. Safouhi, H.; Hoggan, P. E. J Phys A 1999, 32, 6203.
3. Safouhi, H.; Hoggan, P. E. J Math Chem 1999, 25, 259.
4. Safouhi, H.; Hoggan, P. E. J Comput Phys 1999, 155, 331.
5. Vieille, L.; Berlu, L.; Combourieu, B.; Hoggan, P. J Theor Comput Chem 2002, 1(2), 295-308.
6. Berlu, L.; Hoggan, P. J Theor Comput Chem 2003, 2(2), 147-161.
7. Safouhi, H.; Hoggan, P. Mol Phys 2003, 101(1), 19-31.
8. Silverstone, H. J.; Kay, K. G. J Chem Phys 1968, 48, 4108-4115.
9. Silverstone, H. J. J Chem Phys 1966, 45, 4337-4341.
10. Silverstone, H. J. Proc Natl Acad Sci USA 1967, 58, 34-36.
11. Silverstone, H. J. J Chem Phys 1967, 47, 537-540.
12. Silverstone, H. J. J Chem Phys 1968, 48, 4098-4106.
13. Silverstone, H. J. J Chem Phys 1968, 48, 4106-4108.
14. Silverstone, H. J.; Kay, K. G. J Chem Phys 1969, 50, 5045-5047.
15. Kay, K. G.; Silverstone, H. J. J Chem Phys 1969, 51, 956-961.
16. Kay, K. G.; Todd, H. D.; Silverstone, H. J. J Chem Phys 1969, 51, 2359-2362.
17. Kay, K. G.; Todd, H. D.; Silverstone, H. J. J Chem Phys 1969, 51, 2363-2367.
18. Kay, K. G.; Silverstone, H. J. J Chem Phys 1969, 51, 4287-4304.
19. Silverstone, H. J.; Todd, H. D. Int J Quantum Chem 1971, 4, 371-383.
20. Todd, H. D.; Kay, K. G.; Silverstone, H. J. J Chem Phys 1970, 53, 3951-3956.
21. Kay, K. G.; Silverstone, H. J.; Kleiman, B. J Chem Phys 1970, 53, 2545-2546.
22. Kay, K. G.; Silverstone, H. J. J Chem Phys 1970, 53, 4269-4285.
23. Antolovic, D.; Delhalle, J. Phys Rev A 1980, 21, 1815.
24. Antolovic, D. On the analytical and computational aspects of the (2-2)-type three center integrals over Slater type atomic orbitals. Ph.D. Dissertation, Johns Hopkins University, Baltimore, MD, 1983. [Available from University Microfilms International, Ann Arbor, MI, U.M.I. No. 83-16941].
25. Todd, H. D.; Daiker, K. C.; Cloney, R. D.; Moats, R. K.; Silverstone, H. J. In ETO Multicenter Integrals; Weatherford, C. A.; Jones, H. W., Eds.; Reidel: New York, 1982; p 73-89.
26. Handbook of Mathematical Functions; Abramowitz, M.; Stegun, I. A., Eds.; Appl Math Ser No. 55, National Bureau of Standards, Washington, DC, 1964.