Molecular polarizability in quantum defect theory: Nonpolar molecules

Physical Review A - Atomic, Molecular, and Optical Physics

Volumn 79, Issue 3, 2009, Pages

  Akindinova, E V ^a   Chernov, V E ^a   Kretinin, I Yu ^a   Zon, B A ^a  

^a VORONEZH STATE UNIVERSITY   (Russian Federation)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMIC SPECTROSCOPY; DIFFERENTIAL EQUATIONS; GREEN'S FUNCTION; OLIGOMERS; QUANTUM THEORY; SODIUM;

AB-INITIO CALCULATIONS; ALKALI-METAL DIMERS; BENCHMARK CALCULATIONS; DYNAMIC POLARIZABILITIES; H2 MOLECULES; MOLECULAR POLARIZABILITY; NON-POLAR MOLECULES; QUANTUM DEFECT THEORIES; QUANTUM DEFECTS;

MOLECULES;

EID: 63149149453     PISSN: 10502947     EISSN: 10941622     Source Type: Journal    
DOI: 10.1103/PhysRevA.79.032506     Document Type: Article

References (78)

1. L. D. Barron, Molecular Light Scattering and Optical Activity (Cambridge University Press, London, 2004).
2. A. D. Buckingham and B. D. Uttin, Annu. Rev. Phys. Chem. 21, 287 (1970) 10.1146/annurev.pc.21.100170.001443
3. V. Magnasco and R. McWeeny, in Theoretical Models of Chemical Bonding, Part 4: Theoretical Treatment of Large Molecules and Their Interactions, edited by, Z. B. Maksic, (Springer, Berlin, 1991).
4. B. A. Zon and B. G. Katsnel'son, Sov. Phys. JETP 42, 595 (1976)
5. B. Friedrich and D. Herschbach, Phys. Rev. Lett. 74, 4623 (1995) 10.1103/PhysRevLett.74.4623
6. B. A. Zon, Eur. Phys. J. D 8, 377 (2000) 10.1007/s100530050047
7. H. Stapelfeldt and T. Seideman, Rev. Mod. Phys. 75, 543 (2003). 10.1103/RevModPhys.75.543
8. S. Kotochigova and E. Tiesinga, Phys. Rev. A 73, 041405 (R) (2006). 10.1103/PhysRevA.73.041405
9. R. Fulton, A. I. Bishop, P. Barker, and M. N. Shneider, Nat. Phys. 2, 465 (2006) 10.1038/nphys339
10. B. Friedrich and G. Meijer, Nat. Phys. 2, 437 (2006). 10.1038/nphys346
11. S. P. A. Sauer, The Ab Initio Calculation of Molecular Properties, reprint of 2nd ed., Textbook for the 3rd MERCOSUR Institute on Molecular Physics, (Universidad National del Nordeste, Corrientes, 2001).
12. J. Gauss, Modern Methods and Algorithms of Quantum Chemistry, NIC Series Vol. 1 (John von Neumann Institute for Computing, Jülich, 2000), p. 509.
13. G. Maroulis, J. Comput. Methods Sci. Eng. 4 (2004), special issue on computational aspects of electric polarizability calculations.
14. D. Pugh, Chemical Modelling: Applications and Theory, Vol. 4, edited by, A. Hinchliffe, (RSC Publishing, Cambridge, UK, 2006), p. 69.
15. Molecular Applications of Quantum Defect Theory, edited by, Ch. Jungen, (IOP Publishing, Bristol, 1996).
16. B. A. Zon, N. L. Manakov, and L. P. Rapoport, Dokl. Akad. Nauk SSSR 188, 560 (1969)
17. B. A. Zon, N. L. Manakov, and L. P. Rapoport, [Sov. Phys. Dokl. 14, 904 (1970)].
18. V. A. Davydkin, B. A. Zon, N. L. Manakov, and L. P. Rapoport, Zh. Eksp. Teor. Fiz. 60, 124 (1971)
19. V. A. Davydkin, B. A. Zon, N. L. Manakov, and L. P. Rapoport, [Sov. Phys. JETP 33, 70 (1971)].
20. P. G. Alcheev, V. E. Chernov, and B. A. Zon, J. Mol. Spectrosc. 211, 71 (2002) 10.1006/jmsp.2001.8465
21. P. G. Alcheev, R. J. Buenker, V. E. Chernov, and B. A. Zon, J. Mol. Spectrosc. 218, 190 (2003). 10.1016/S0022-2852(02)00091-7
22. V. E. Chernov, D. L. Dorofeev, I. Yu. Kretinin, and B. A. Zon, Phys. Rev. A 71, 022505 (2005). 10.1103/PhysRevA.71.022505
23. V. E. Chernov, D. L. Dorofeev, I. Yu. Kretinin, and B. A. Zon, J. Phys. B 38, 2289 (2005). 10.1088/0953-4075/38/13/020
24. D. L. Dorofeev, B. A. Zon, I. Yu. Kretinin, and V. E. Chernov, Opt. Spectrosc. 99, 540 (2005) 10.1134/1.2113366
25. D. L. Dorofeev, B. A. Zon, I. Yu. Kretinin, and V. E. Chernov, [Opt. Spektrosk. 99, 562 (2005)]. 10.1134/1.2113366
26. B. A. Zon, I. Yu. Kretinin, and V. E. Chernov, Opt. Spectrosc. 101, 501 (2006) 10.1134/S0030400X06100018
27. B. A. Zon, I. Yu. Kretinin, and V. E. Chernov, [Opt. Spektrosk. 101, 533 (2006)]. 10.1134/S0030400X06100018
28. D. M. Bishop, Rev. Mod. Phys. 62, 343 (1990). 10.1103/RevModPhys.62.343
29. J. M. Luis, M. Torrent-Sucarrat, O. Christiansen, and B. Kirtman, J. Chem. Phys. 127, 084118 (2007). 10.1063/1.2770709
30. V. A. Davydkin and L. P. Rapoport, Opt. Spektrosk. 35, 377 (1973).
31. V. A. Davydkin and L. P. Rapoport, J. Phys. B 7, 1101 (1974). 10.1088/0022-3700/7/9/022
32. W. Kolos and L. Wolniewicz, J. Chem. Phys. 46, 1426 (1967). 10.1063/1.1840870
33. R. L. Wilkins and H. S. Taylor, J. Chem. Phys. 48, 4934 (1968). 10.1063/1.1668159
34. A. L. Ford and J. C. Browne, Phys. Rev. A 7, 418 (1973). 10.1103/PhysRevA.7.418
35. D. M. Bishop and L. M. Cheung, J. Chem. Phys. 72, 5125 (1980). 10.1063/1.439745
36. J. Rychlewski, Chem. Phys. Lett. 73, 135 (1980). 10.1016/0009-2614(80) 85220-1
37. R. M. Berns and P. E. S. Wormer, Mol. Phys. 44, 1215 (1981). 10.1080/00268978100103131
38. M. Jaszúnski and B. O. Roos, Mol. Phys. 52, 1209 (1984). 10.1080/00268978400101881
39. E.-A. Reinsch, J. Chem. Phys. 83, 5784 (1985). 10.1063/1.449657
40. D. M. Bishop and J. Pipin, Phys. Rev. A 36, 2171 (1987). 10.1103/PhysRevA.36.2171
41. S. P. A. Sauer, G. H. F. Dierksen, and J. Oddershede, Int. J. Quantum Chem. 39, 667 (1991). 10.1002/qua.560390504
42. M. Caffarel, M. Rerat, and C. Pouchan, Phys. Rev. A 47, 3704 (1993). 10.1103/PhysRevA.47.3704
43. M. G. Papadopoulos, J. Waite, and A. D. Buckingham, J. Chem. Phys. 102, 371 (1995). 10.1063/1.469412
44. S. J. A. van Gisbergen, F. Kootstra, P. R. T. Schipper, O. V. Gritsenko, J. G. Snijders, and E. J. Baerends, Phys. Rev. A 57, 2556 (1998). 10.1103/PhysRevA.57.2556
45. J. Kobus, D. Moncrieff, and S. Wilson, J. Phys. B 34, 5127 (2001). 10.1088/0953-4075/34/24/314
46. M. A. Buldakov, V. N. Cherepanov, and N. S. Nagornova, Comput. Lett. 3, 115 (2007).
47. P. Krause, T. Klamroth, and P. Saalfrank, J. Chem. Phys. 127, 034107 (2007). 10.1063/1.2749503
48. A. M. Machado and M. Masili, J. Chem. Phys. 120, 7505 (2004). 10.1063/1.1687677
49. Æ. Frisch and M. J. Frisch, Gaussian 98 User's Reference (Gaussian, Inc., Pittsburgh, 1998).
50. C. C. J. Roothan, Rev. Mod. Phys. 23, 69 (1951). 10.1103/RevModPhys.23.69
51. G. A. Petersson and M. A. Al-Laham, J. Chem. Phys. 94, 6081 (1991). 10.1063/1.460447
52. H. E. Montgomery, Jr., Chem. Phys. Lett. 50, 455 (1977). 10.1016/0009-2614(77)80365-5
53. J. M. Peek, J. Chem. Phys. 43, 3004 (1965). 10.1063/1.1697265
54. G. Staszewska and L. Wolniewicz, J. Mol. Spectrosc. 212, 208 (2002). 10.1006/jmsp.2002.8546
55. L. Wolniewicz and G. Staszewska, J. Mol. Spectrosc. 220, 45 (2003). 10.1016/S0022-2852(03)00121-8
56. L. Wolniewicz and G. Staszewska, J. Mol. Spectrosc. 217, 181 (2003). 10.1016/S0022-2852(02)00047-4
57. P. W. Landolt and B. Börnstein Zahlenwerte und Funktionen, Landolt-Börnstein, New Series, Vol. 1, Pt. 3, 1st ed. (Springer-Verlag, Berlin, 1951).
58. P. L. Smith, M. C. E. Huber, and W. H. Parkinson, Phys. Rev. A 13, 1422 (1976). 10.1103/PhysRevA.13.1422
59. R. Poteau and F. Spiegelmann, J. Mol. Spectrosc. 171, 299 (1995). 10.1006/jmsp.1995.1120
60. M. Rerat, C. Pouchan, M. Tadjeddine, J. P. Flament, H. P. Gervais, and G. Berthier, Phys. Rev. A 43, 5832 (1991). 10.1103/PhysRevA.43.5832
61. M. Merawa and M. Rerat, Eur. Phys. J. D 17, 329 (2001). 10.1007/s100530170007
62. D. K. Watson, Chem. Phys. Lett. 51, 513 (1977). 10.1016/0009-2614(77) 85413-4
63. T. Uzer and A. Dalgarno, Chem. Phys. 51, 271 (1980). 10.1016/0301- 0104(80)80102-9
64. L. B. Ratcliff, J. L. Fish, and D. D. Konowalow, J. Mol. Spectrosc. 122, 293 (1987). 10.1016/0022-2852(87)90006-3
65. W. Muller and W. Meyer, J. Chem. Phys. 85, 953 (1986). 10.1063/1.451251
66. M. Urban and A. J. Sadlej, J. Chem. Phys. 103, 9692 (1995). 10.1063/1.469984
67. V. Tarnovsky, M. Bunimovicz, L. Vukovic, B. Stumpf, and B. Bederson, J. Chem. Phys. 98, 3894 (1993). 10.1063/1.464017
68. J. Li, Y. Liu, X. Dai, L. Li, and R. W. Field, J. Chem. Phys. 114, 7859 (2001). 10.1063/1.1361252
69. W. J. Stevens, M. M. Hessei, P. J. Bertoncini, and A. C. Wahi, J. Chem. Phys. 66, 1477 (1977). 10.1063/1.434110
70. G. Maroulis, J. Chem. Phys. 121, 10519 (2004). 10.1063/1.1812737
71. D. Spelsberg, T. Lorenz, and W. Meyer, J. Chem. Phys. 99, 7845 (1993). 10.1063/1.465663
72. T. H. Dunning, Jr. and P. J. Hay, Modern Theoretical Chemistry (Plenum, New York, 1976), Vol. 3, pp. 1-28.
73. P. J. Hay and W. R. Wadt, J. Chem. Phys. 82, 270 (1985) 10.1063/1.448799
74. W. R. Wadt and P. J. Hay, J. Chem. Phys. 82, 284 (1985). 10.1063/1.448800
75. S. J. Park, S. W. Suh, Y. S. Lee, and G.-H. Jeung, J. Mol. Spectrosc. 207, 129 (2001). 10.1006/jmsp.2001.8337
76. R. Beuc, M. Movre, V. Horvatic, C. Vadla, O. Dulieu, and M. Aymar, Phys. Rev. A 75, 032512 (2007). 10.1103/PhysRevA.75.032512
77. I. S. Lim, P. Schwerdtfeger, T. Söhnel, and H. Stoll, J. Chem. Phys. 122, 134307 (2005). 10.1063/1.1869979
78. M. Pecul, M. Jaszúski, and P. Jørgensen, Mol. Phys. 98, 1455 (2000). 10.1080/002689700417565