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Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 27, 1974 - Issue 3
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Original Articles

Ab initio calculation of the spin-orbit coupling constant from gaussian lobe SCF molecular wavefunctions

P.W. Abegg Physical Chemistry Institute, University of Zurich, Switzerland
&
Tae-Kyu Ha Laboratory of Physical Chemistry, Swiss Federal Institute of Technology, Zurich, Switzerland
Pages 763-767 | Received 07 Aug 1973, Published online: 22 Aug 2006

References

  • Blume , M. and Watson , R.E. 1962 . Proc. R. Soc. A , 270 : 127 – 127 . 1963, Ibid., 271, 565.
  • Walker , T.E.H. and Richards , W.G. 1968 . Symp. Faraday Soc. , 2 : 64 – 64 . 1970, J. chem. Phys., 52, 1311; 1971, J. Phys. B, 3, 271.
  • Horsley , J.A. and Hall , J.A. 1973 . Molec. Phys. , 25 : 483 – 483 .
  • Ito , H. and I'Haya , Y.J. 1972 . Molec. Phys. , 24 : 1103 – 1103 .
  • Whitten , J.L. 1966 . J. chem. Phys. , 44 : 359 – 359 .
  • Shavitt , I. 1963 . Methods in Computational Physics , Vol. 2 , 1 – 1 . Academic Press .
  • Nesbet , R.K. 1955 . Proc. R. Soc. A , 230 : 312 – 312 . 322; Fink, W. H., 1968, J. chem. Phys., 49, 5054.
  • Abegg , P.W. 1974 . Dissertation , University of Zurich .

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