Intracule functional models: Part III. The dot intracule and its Fourier transform

Physical Chemistry Chemical Physics

Volumn 10, Issue 23, 2008, Pages 3447-3453

  Bernard, Yves A ^a   Crittenden, Deborah L ^a   Gill, Peter M W ^a  

^a AUSTRALIAN NATIONAL UNIVERSITY   (Australia)

Author keywords

[No Author keywords available]

Indexed keywords

AMMONIA; HELIUM; HYDROFLUORIC ACID; METHANE; WATER;

ALGORITHM; ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; ELECTRON; ENERGY TRANSFER; FOURIER ANALYSIS; QUANTUM THEORY; THERMODYNAMICS;

ALGORITHMS; AMMONIA; ELECTRONS; ENERGY TRANSFER; FOURIER ANALYSIS; HELIUM; HYDROFLUORIC ACID; METHANE; MODELS, MOLECULAR; QUANTUM THEORY; THERMODYNAMICS; WATER;

EID: 44949127104     PISSN: 14639076     EISSN: None     Source Type: Journal    
DOI: 10.1039/b803919d     Document Type: Article

References (36)

1. E. Schrödinger Ann. Phys. 1926 79 361
2. D. R. Hartree Proc. Cam. Phil. Soc. 1928 24 89
3. V. Fock Z. Phys. 1930 61 126
4. E. Wigner Phys. Rev. 1934 46 1002
5. A. Szabo and N. S. Ostlund, Modern quantum chemistry, McGraw-Hill, New York, 1989
6. R. G. Parr and W. Yang, Density-functional theory of atoms and molecules, Oxford University Press, Oxford, 1989
7. C. A. Coulson A. H. Neilson Proc. Phys. Soc. 1961 78 831
8. A. M. Lee P. M. W. Gill Chem. Phys. Lett. 1999 313 271
9. K. E. Banyard C. E. Reed J. Phys. B 1978 11 2957
10. N. A. Besley A. M. Lee P. M. W. Gill Mol. Phys. 2002 100 1763
11. V. A. Rassolov J. Chem. Phys. 1999 110 3672
12. E. Wigner Phys. Rev. 1932 40 749
13. H. J. Groenewold Physica 1946 12 405
14. D. L. Crittenden P. M. W. Gill J. Chem. Phys. 2007 127 014101
15. P. M. W. Gill D. L. Crittenden D. P. O'Neill N. A. Besley Phys. Chem. Chem. Phys. 2006 8 15
16. P. M. W. Gill D. P. O'Neill N. A. Besley Theor. Chem. Acc. 2003 109 241
17. P. M. W. Gill D. P. O'Neill J. Chem. Phys. 2005 122 094110
18. R. Fondermann M. Hanrath M. Dolg D. P. O'Neill Chem. Phys. Lett. 2005 413 237
19. N. A. Besley J. Chem. Phys. 2006 125 074101
20. R. Fondermann M. Hanrath M. Dolg Theor. Chem. Acc. 2007 118 777
21. E. E. Dumont D. L. Crittenden P. M. W. Gill Phys. Chem. Chem. Phys. 2007 9 5340
22. D. L. Crittenden E. E. Dumont P. M. W. Gill J. Chem. Phys. 2007 127 141103
23. N. A. Besley D. P. O'Neill P. M. W. Gill J. Chem. Phys. 2003 118 2033
24. S. F. Boys Proc. R. Soc. (London) 1950 A200 542
25. Y. Shao L. Fusti-Molnar Y. Jung J. Kussmann C. Ochsenfeld S. T. Brown A. T. B. Gilbert L. V. Slipchenko S. V. Levchenko D. P. O'Neill, et al. Phys. Chem. Chem. Phys. 2006 8 3172
26. J. K. Pearson D. L. Crittenden P. M. W. Gill Chem. Phys.
27. M. Abramowitz and I. E. Stegun, Handbook of mathematical functions, Dover, New York, 1972
28. G. A. Evans K. C. Chung Int. J. Comput. Math. 1998 66 39
29. R. Wong, Asymptotic approximations of integrals, SIAM, Philadelphia, 2001
30. Wolfram Research, Inc., Mathematica, Champaign, Illinois, version 6.0 ed., 2007
31. J. P. Boyd, Chebyshev and Fourier spectral methods, Dover, New York, 2nd edn., 2000
32. M. Reed and B. Simon, Methods of modern mathematical physics, Academic Press, New York, 1975, vol. 2
33. J. A. Pople M. Head-Gordon D. J. Fox K. Raghavachari L. A. Curtiss J. Chem. Phys. 1989 90 5622
34. D. P. O'Neill P. M. W. Gill Mol. Phys. 2005 103 763
35. L. Debnath and D. Bhatta, Integral transforms and their applications, Chapman and Hall, 2nd edn, 2007
36. W. Kolos K. Szalewicz H. J. Monkhorst J. Chem. Phys. 1986 84 3278