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Static dipole polarizabilities of open-shell negative ions

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Summary

Dipole polarizability estimates at λ ⇒ ∞ have been calculated for the 2p and 3p open-shell negative ions in their ground and valence excited states. To complete the sequence such estimates for F− and Cl− in their ground1 S state have also been made. Single configuration based linear response theory has been adopted presently with a view to study the effect of RPA-type correlations on the polarizabilities of such systems. For the 3p open-shell systems the innermost 1s core has been kept frozen. Most of the results are reported for the first time. Agreement with existing data, wherever available, is reasonable. The convergence of the polarizability estimates towards basis sets has been studied.

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References

  1. Rittner ES (1951) J Chem Phys 19:1030

    Google Scholar 

  2. Ruffa AR (1963) Phys Rev 130:1412

    Google Scholar 

  3. Wilson JN, Curtis RM (1970) J Phys Chem 74:187

    Google Scholar 

  4. Brumer P, Karplus M (1973) J Chem Phys 58:3903

    Google Scholar 

  5. Winslow GH (1975) J Chem Phys 62:4138

    Google Scholar 

  6. Schrader DM (1979) Phys Rev A20:933

    Google Scholar 

  7. Miller TM, Bederson B (1977) Adv At Mol Phys 17:1

    Google Scholar 

  8. Maessen B, Schmidt PC (1981) Theor Chim Acta 59:299

    Google Scholar 

  9. Schmidt PC, Sen KD, Weiss A, Das TP (1979) Phys Rev B19:5525

    Google Scholar 

  10. Sen KD, Schmidt PC (1981) Int J Quantum Chem 19:373

    Google Scholar 

  11. Bauer N, Fajans K (1942) J Am Chem Soc 64:3023

    Google Scholar 

  12. Tessman JR, Kahn AH, Schokley W (1953) Phys Rev 92:890

    Google Scholar 

  13. Coker H (1976a) J Phys Chem 80:2078; (1976b) J Phys Chem 80:2084

    Google Scholar 

  14. Langhoff PW, Hurst RP (1965) Phys Rev 139A:1415

    Google Scholar 

  15. Cohen MD (1966) J Chem Phys 45:10

    Google Scholar 

  16. Maroulis G, Bishop DM (1986a) Mol Phys 57:359; (1986b) J Phys B19:369

    Google Scholar 

  17. McEachran RP, Stauffer AD, Susan Greita (1979) J Phys B12:3119

    Google Scholar 

  18. Stewart RF (1975) Mol Phys 29:787

    Google Scholar 

  19. Diercksen GHF, Sadlej A (1982) Mol Phys 47:33

    Google Scholar 

  20. Sadlej A (1983) Int J Quantum Chem 23:147

    Google Scholar 

  21. Kucharski SA, Lee YS, Purvis GD, Bartlett RJ (1984) Phys Rev A29:1619

    Google Scholar 

  22. Lahiri J, Mukherji A (1967) Phys Rev 155:24

    Google Scholar 

  23. Kutzner M, Kelly HP, Larson DJ, Altun Z (1988) Phys Rev A38:5107

    Google Scholar 

  24. Canuto S, Duch W, Geertsen J, Mullet-Plathe F, Oddershede J, Scuseria GE (1988) Chem Phys Lett 147:435

    Google Scholar 

  25. Pouchan C, Bishop DM (1984) Phys Rev A29:1

    Google Scholar 

  26. Agren H, Olson J, Jensen HJ, Jorgensen P (1989) Phys Rev A40:2265

    Google Scholar 

  27. Glover RM, Weinhold F (1976) J Chem Phys 65:4913

    Google Scholar 

  28. Caves TC, Karplus M (1969) J Chem Phys 50:3649

    Google Scholar 

  29. McCurdy CW, Rescigno TN, Yeager DL, McKoy V (1977) Schaefer HF III (ed) Methods of electronic structure theory, Plenum Press, NY, p 339

    Google Scholar 

  30. Kundu B, Ray D, Mukherjee PK (1986) Phys Rev A34:62

    Google Scholar 

  31. Kundu B, Mukherjee PK (1987) Phys Rev A35:980

    Google Scholar 

  32. Mukherjee PK, Ohtsuki K, Ohno Kimio (1988) Theor Chim Acta 74:113

    Google Scholar 

  33. Mukherjee PK, Ohno Kimio (1989) Phys Rev A40:1753

    Google Scholar 

  34. Clementi E, Roetti C (1974) At Data Nucl Data Tables 14:177

    Google Scholar 

  35. Schmidt PC, Sen KD, Weiss A (1980) Ber Bunsenges Phys Chem 84:1240

    Google Scholar 

  36. Wilson S, Sadlej AJ (1981) Theor Chim Acta 60:19

    Google Scholar 

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Authors and Affiliations

  1. Department of Spectroscopy, Indian Association for the Cultivation of Science, 700 032, Jadavpur, Calcutta, India

    A. K. Das, D. Ray & P. K. Mukherjee

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  1. A. K. Das
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  2. D. Ray
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  3. P. K. Mukherjee
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Das, A.K., Ray, D. & Mukherjee, P.K. Static dipole polarizabilities of open-shell negative ions. Theoret. Chim. Acta 82, 223–227 (1992). https://doi.org/10.1007/BF01113254

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  • DOI: https://doi.org/10.1007/BF01113254

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