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Calculations of EPR isotropic hyperfine splitting constants by the MINDO/3 method

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Literature Cited

  1. C. C. J. Roothaan, Rev. Mod. Phys.,32, 179 (1960).

    Google Scholar 

  2. H. C. Longuet-Higgins and J. A. Pople, Proc. Phys. Soc.,A68, 591 (1955).

    Google Scholar 

  3. S. T. Epstein, Variation Method in Quantum Chemistry [Russian translation] Mir, Moscow (1977).

    Google Scholar 

  4. M. F. Guest and V. R. Saunders, Mol. Phys.,28, 819 (1974).

    Google Scholar 

  5. M. M. Mestechkin, Int. J. Quantum Chem.,13, 469 (1978).

    Google Scholar 

  6. R. C. Bingham, M. J. S. Dewar and D. H. Lo, J. Am. Chem. Soc.,97, 1285 (1975).

    Google Scholar 

  7. M. M. Mestechkin, G. E. Vaiman, V. Klimo, and J. Tiňo, Extended Hartree-Fock Method and Its Application to Molecules [in Russian], Nauk. Dumka, Kiev (1983).

    Google Scholar 

  8. J. Tiňo, V. Klimo, and M. M. Mestechkin, Coll. Czech. Chem. Comm.,45, 3283 (1980).

    Google Scholar 

  9. D. M. Himmelblau, Applied Nonlinear Programming [Russian translation] Mir, Moscow (1975).

    Google Scholar 

  10. G. M. Zhidomirov, P. V. Schastnev, and N. D. Chuvylkin, Quantum Chemical Calculations of Magnetic Resonance Parameters [in Russian], Nauka, Novosibirsk (1978).

    Google Scholar 

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Institute of Physical Organic Chemistry and Carbon Chemistry, Academy of Sciences of the Ukrainian SSR. Translated from Zhurnal Strukturnoi Khimii, Vol. 29, No. 1, pp. 165–167, January–February, 1988.

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Vaiman, G.E., Dmitruk, A.F., Zarechnaya, O.M. et al. Calculations of EPR isotropic hyperfine splitting constants by the MINDO/3 method. J Struct Chem 29, 150–151 (1988). https://doi.org/10.1007/BF00750189

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