Publication Cover
Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 58, 1986 - Issue 5
25
Views
21
CrossRef citations to date
0
Altmetric
Original Articles

The spin density and the optical spectrum of CoCl2-4

An MC SCF study using the Madelung potential from Cs3CoCl5

&
Pages 965-975 | Received 12 Dec 1985, Accepted 10 Mar 1986, Published online: 22 Aug 2006

References

  • Figgis , B.N. , Reynolds , P.A. , Williams , G.A. , Mason , R. , Smith , A.R.P. and Varghese , J.N. 1980 . J. chem. Soc. Dalton Trans. , : 2333 – 2333 . Brown, P. J., Forsyth, J. B., and Mason, R., 1980, Phil. Trans. R. Soc. B, 290, 481.
  • Cotton , F.A. , Goodgame , D.M.L. and Goodgame , M. 1961 . J. Am. chem. Soc. , 83 : 4690 – 4690 .
  • Ferguson , J. 1961 . J. chem. Phys. , 39 : 116 – 116 .
  • Jesson , J.P. 1968 . J. chem. Phys. , 48 : 161 – 161 .
  • Bird , B.D. , Cooke , E.A. , Day , P. and Orchard , A.F. 1974 . Phil. Trans. R. Soc. A , 276 : 277 – 277 . and references therein
  • Lakshman , S.V.J. and Reddy , B.C.V. 1976 . Indian J. pure appl. Phys. , 14 : 453 – 453 . Murthy, V. L. R., and Lakshman, S. V. J., 1982, Indian J. pure appl. Phys., 20, 53. Murthy, V. L. R., and Lakshman, S. V. J., 1982, Theochem., 5, 205.
  • Hillier , I.H. , Kendrick , J. , Mabbs , F.E. and Garner , C.D. 1976 . J. Am. chem. Soc. , 98 : 395 – 395 .
  • Chandler , G.S. and Phillips , R.A. 1980 . Chem. Phys. Lett. , 75 : 363 – 363 .
  • Phillips , R.A. 1982 . A Theoretical Investigation of the Molecular Properties and Spin Densities of Some Selected Compounds of Co, Cr and Ni , The University of Western Australia . (thesis)
  • Chandler , G.S. and Phillips , R.A. submitted for publication
  • Figgis , B.N. , Mason , R. , Smith , A.R.P. and Williams , G.A. 1980 . Acta crystallogr. B , 36 : 509 – 509 .
  • The integral program is written by J. Almlöf. Modifications by Bagus P.S. Johansen H.
  • The ALCHEMY program system is written by Bagus P.S. Liu B. Yoshimine M. McLean A.D. Modifications by S. Rettrup
  • Roos , B.O. , Taylor , P.R. and Siegbahn , P.E.M. 1980 . Chem. Phys. , 48 : 157 – 157 . Roos B.O., 1980, Intern. J. quantum Chem., S14, 175.
  • The program SPINDEN is written by Johansen H.
  • The program MOLPLOT is written by Johansen H.
  • Almlöf , J. and Wahlgren , U. 1973 . Theor. chim. Acta , 28 : 161 – 161 .
  • Hermansson , K. 1984 . The Electron Distribution in the Bound Water Molecule , Uppsala University . (thesis)
  • Bagus , P.S. and Wahlgren , U. 1977 . Molec. Phys. , 33 : 641 – 641 . Johansen, H., and Wahlgren, U., 1977, Molec. Phys., 33, 651.
  • Griffith , J.S. 1971 . The Theory of Transition-Metal Ions , Cambridge University Press . Appendix 2
  • Moore , C.E. 1952 . Natn. Bur. Stand. Circ. 467 , 2
  • Quinn , M.B. and Smith , D.W. 1971 . J. chem. Soc. A , : 2496 – 2496 .
  • Stapele , R.P. , van Beljers , H.G. , Bongers , P.F. and Zijlstra , H. 1966 . J. chem. Phys. , 44 : 3719 – 3719 .

Reprints and Corporate Permissions

Please note: Selecting permissions does not provide access to the full text of the article, please see our help page How do I view content?

To request a reprint or corporate permissions for this article, please click on the relevant link below:

Academic Permissions

Please note: Selecting permissions does not provide access to the full text of the article, please see our help page How do I view content?

Obtain permissions instantly via Rightslink by clicking on the button below:

If you are unable to obtain permissions via Rightslink, please complete and submit this Permissions form. For more information, please visit our Permissions help page.