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Calculation of the optical characteristics of atoms with a filled shell on the basis of the Hartree-Fock method

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Abstract

For He, Be, Ne, and Mg atoms and their isoelectronic series the dipole dynamic polarizability, the oscillator energies, and the strengths of lower transitions are calculated with the use of the nonstationary perturbation theory in the Hartree-Fock-Roothaan method. The problem of choosing the dimension and composition of the basis of atomic orbitals of the Slater type is studied, within the framework of which the Hartree-Fock limit of the quantities calculated is reached.

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References

  1. A. Dalgarno and G. A. Victor,Proc. Roy. Soc. (London),A291, 291–299 (1966).

    ADS  Google Scholar 

  2. R. F. Stewart,J. Phys. B.,8, No. 1, 1–10 (1975).

    Article  ADS  Google Scholar 

  3. R. F. Stewart,Mol. Phys.,29, No. 5, 1577–1583 (1975).

    Article  Google Scholar 

  4. R. F. Stewart,Mol. Phys.,30, No. 3, 745–754 (1975).

    Article  Google Scholar 

  5. R. F. Stewart,Mol. Phys.,30, No. 1, 283–290 (1975).

    Google Scholar 

  6. V. F. Brattsev and N. V. Khodyreva,Opt. Spektrosk.,54, No. 5, 925–927 (1983).

    Google Scholar 

  7. V. F. Brattsev and N. V. Khodyreva,Vestn. LGU, No. 4, 66–74 (1979).

  8. V. F. Brattsev and N. V. Khodyreva,Opt. Spektrosk.,57, No. 6, 1092–1094 (1984).

    Google Scholar 

  9. V. F. Brattsev and N. V. Khodyreva,Opt. Spektrosk.,50, No. 2, 222–230 (1981).

    Google Scholar 

  10. G. P. Arrighini and C. Guidotti,Mol. Phys. A,24, No. 3, 631–640 (1972).

    Article  Google Scholar 

  11. Yu. Yu. Dmitriev, Yu. B. Malykhanov, and B. Rus,Opt. Spektrosk.,57, No. 3, 556–559 (1984).

    Google Scholar 

  12. M. A. Kukanov and Yu. B. Malykhanov,Zh. Strukt. Khim.,27, 166–169 (1986).

    Google Scholar 

  13. H. P. Roy, A. Gupta, and P. K. Mukherjee,Int. J. Quant. Chem.,9, 75–81 (1975).

    Article  Google Scholar 

  14. Yu. B. Malykhanov and R. N. Pravosudov,Zh. Strukt. Khim.,41, No. 3 (2000) (in press).

    Google Scholar 

  15. Yu. B. Malykhanov and M. M. Mestechkin,Opt. Spektrosk.,33, No. 3, 464–473 (1972).

    Google Scholar 

  16. M. M. Mestechkin,Teor. Éksp. Khim.,12, No. 6, 739–745 (1976).

    Google Scholar 

  17. D. K. Watson, R. F. Stewart, and A. Dalgarno,J. Chem. Phys.,64, No. 12, 4995–4999 (1976).

    Article  ADS  Google Scholar 

  18. D. Taules,Quantum Mechanics of Multiparticle Systems [in Russian], Moscow (1963).

  19. D. H. Wilkinson and K. Rinesh,Handbook of Algorithms in ALGOL. Linear Algebra [Russian translation], Moscow (1976).

  20. Yu. B. Malykhanov, R. N. Pravosudov, and V. V. Meshkov,Zh. Strukt. Khim.,41, No. 2, (2000) (in press).

  21. H. D. Cohen and C. C. J. Roothaan,J. Chem. Phys.,43, No. 10, S34-S39 (1965).

    Article  Google Scholar 

  22. S. Fujinaga,Method of Molecular Orbitals [Russian translation], Moscow (1983).

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Authors and Affiliations

  1. M. E. Evsev’ev Mordovian State Pedagogical Institute, 11a Studencheskaya Str., 430007, Saransk, Russia

    Yu. B. Malykhanov & R. N. Pravosudov

Authors
  1. Yu. B. Malykhanov
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  2. R. N. Pravosudov
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Corresponding author

Correspondence to Yu. B. Malykhanov.

Additional information

Translated from Zhurnal Prikladnoi Spektroskopii, Vol. 67, No. 1, pp. 5–10, January–February, 2000.

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Malykhanov, Y.B., Pravosudov, R.N. Calculation of the optical characteristics of atoms with a filled shell on the basis of the Hartree-Fock method. J Appl Spectrosc 67, 1–8 (2000). https://doi.org/10.1007/BF02681412

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  • DOI: https://doi.org/10.1007/BF02681412

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