SCOPUS 정보 검색 플랫폼

Volumn 95, Issue 8, 1991, Pages 5889-5897

The reduced multiplication scheme of the Rys quadrature and new recurrence relations for auxiliary function based two-electron integral evaluation

(3) Lindh, R a,b Ryu, U a,c Liu, B a

a IBM ALMADEN RESEARCH CENTER (United States)

b LUND UNIVERSITY (Sweden)

c Korea Advanced Institute of Science and Technology (KAIST) (South Korea)

Author keywords

[No Author keywords available]

Indexed keywords

DIGITAL ARITHMETIC; HARMONIC ANALYSIS;

AUXILIARY FUNCTIONS; BASIS FUNCTIONS; FLOATING POINT OPERATIONS; INTEGRAL PROGRAMS; RECURRENCE RELATIONS; SPHERICAL HARMONICS; TRANSFER EQUATION; TWO-ELECTRON INTEGRALS;

FUNCTION EVALUATION;

EID: 0000226853 PISSN: 00219606 EISSN: None Source Type: Journal
DOI: 10.1063/1.461610 Document Type: Article

Times cited : (256)

References (26)

1
- 0000567090
- (1950) Proc. R. Soc. London, Ser. A , vol.200 , pp. 542
- Boys, S.F.¹

2
- 0001142721
- (1976) J. Comput. Phys. , vol.21 , pp. 144
- King, H.F.¹ Dupuis, M.²

3
- 36749119370
- (1976) J. Chem. Phys. , vol.65 , pp. 111
- Dupuis, M.¹ Rys, J.² King, H.F.³

4
- 84986465499
- (1983) J. Comput. Chem. , vol.4 , pp. 154
- Rys, J.¹ Dupuis, M.² King, H.F.³

5
- 0000732350
- (1978) J. Comput. Phys. , vol.26 , pp. 218
- McMurchie, L.E.¹ Davidson., E.R.²

6
- 36549098458
- (1986) J. Chem. Phys. , vol.84 , pp. 3963
- Obara, S.¹ Saika, A.²

7
- 0000000502
- (1988) J. Chem. Phys. , vol.89 , pp. 5777
- Head-Gordon, M.¹ Pople, J.A.²

8
- 84990706845
- (1989) Int. J. Quantum Chem. , vol.S23 , pp. 269
- Gill, P.M.W.¹ Head-Gordon, M.² Pople, J.A.³

9
- 11744301971
- (1990) J. Phys. Chem. , vol.94 , pp. 5564
- Gill, P.M.W.¹ Head-Gordon, M.² Pople, J.A.³

10
- 84953822397
- (1801–1879). Governor of New York (1839-43), U.S. senator (1849-61), and served as Secretary of State (1861-69) under the presidencies of Abraham Lincoln and Andrew Johnson. He negotiated the purchase of Alaska from tzarist Russia in 1867. The price of Alaska was two cents an acre. The deal was spoken of at the time as “Seward’s folly,�
- Seward, W.H.¹

11
- 0002708849
- edited by B. Alder, S. Fernbach, and M. Rotenberg, (Academic, New York)
- (1963) Methods in Computational Physics , vol.2 , pp. 1
- Shavitt, I.¹

12
- 84990639646
- (1983) Int. J. Quantum Chem. , vol.23 , pp. 1135
- Hegarty, D.¹ van der Velde, G.²

13
- 0001461294
- (1978) J. Comput. Chem. , vol.27 , pp. 161
- Pople, J.A.¹ Hehre, W.J.²

14
- 0000852374
- edited by G. H. F. Diercksen, B. T. Sutcliffe, and A. Veillard, (Reidel, Dordrecht)
- (1975) Computational Techniques in Quantum Chemistry and Molecular Physics , pp. 347
- Saunders, V.R.¹

15
- 33645295056
- edited by G. H. F. Diercksen and S. Wilson (Rei-del, Dordrecht)
- (1983) Methods in Computational Physics , pp. 1
- Saunders, V.R.¹

16
- 84953822394
- in Invited Papers Presented by the Scientific Engineering Computations Department at the Santa Clara 4th International Conference on Supercomputing
- (1989)
- Dupuis, M.¹ Mougenot, P.² Lindh, R.³ Dyall, K.⁴ Liu, B.⁵

17
- 0003990718
- Issue 4.0, Cambridge, 1987.
- CADPAC: the Cambridge Analytical Derivative Package
- Amos, R.D.¹ Rice, J.E.²

18
- 85034883020
- GAUSSIAN 88, Gaussian, Inc. Pittsburgh, PA
- (1988)
- Frisch, M.J.¹ Head-Gordon, M.² Schlegel, H.B.³ Raghavachari, K.⁴ Binkley, J.S.⁵ Gonzalez, C.⁶ DeFrees, D.J.⁷ Fos, D.J.⁸ Whiteside, R.A.⁹ Melius, C.F.¹⁰ Baker, J.¹¹ Martin, R.¹² Kahn, L.R.¹³ Stewart, J.J.P.¹⁴ Fluder, E.M.¹⁵ Topiol, S.¹⁶ Pople, J.A.¹⁷

19
- 84953822404
- a version of J. Almlöfs integral code MOLECULE vectorized for the IBM 3090 mainframe
- Lee, Y.¹ Barnes, L.² Liu, B.³

20
- 11744283687
- (1969) J. Chem. Phys. , vol.51 , pp. 2657
- Hehre, W.J.¹ Stewart, R.F.² Pople, J.A.³

21
- 33845307371
- J. Chem. Phys.
- (1976) J. Chem. Phys. , vol.64 , pp. 5142
- Collins, J.B.¹ Schleyer, P.V.R.² Binkley, J.S.³ Pople, J.A.⁴

22
- 0003568278
- (Plenum, New York)Chap. 1 p. 1
- (1976) Modern Theoretical Chemistry
- Dunning, T.H.¹ Hay, P.J.²

23
- 36849140788
- Exponents
- (1965) J. Chem. Phys. , vol.42 , pp. 1293
- Huzinaga, S.¹

24
- 35348906888
- coefficients
- (1971) J. Chem. Phys. , vol.55 , pp. 716
- Dunning, T.H.¹

25
- 0042106817
- (1990) Theor. Chim. Acta , vol.77 , pp. 291
- Widmark, P.-O.¹ Malmqvist, P.-A.² Roos, B.O.³

26
- 0000263710
- (1991) Chem. Phys. , vol.150 , pp. 163
- Hamilton, T.P.¹ Schaefer, H.F.²

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