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    International Journal of Quantum Chemistry: Volume 48, Issue 5

    fmi-fmii, 277-342
    5 December 1993
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  • Pages: fmi-fmii
  • First Published: 5 December 1993

Articles

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Geometrical, spectroscopic, and magnetic properties of an oxygen atom adsorbed on the Ni(100) surface

Annick Goursot,  Franca Mele,  Nino Russo,  Dennis R. Salahub,  Marirosa Toscano, 
  • Pages: 277-286
  • First Published: 5 December 1993
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Topological analysis of the charge density of solids: bcc sodium and lithium

Changjiang Mei,  Kenneth E. Edgecombe,  Vedene H. Smith,  A. Heilingbrunner, 
  • Pages: 287-293
  • First Published: 5 December 1993
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Multipole moment analysis for hydrides, fluorides, and lithium compounds of first- and second-row elements

Andreas M. Köster,  Karl Jug, 
  • Pages: 295-308
  • First Published: 5 December 1993
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Second-order Jahn–Teller instability and the activation energy for Al+(1S) + H2 → AlH+(2∑+) + H

Jon Rusho,  Jeff Nichols,  Jack Simons, 
  • Pages: 309-317
  • First Published: 5 December 1993
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Fluorination effect on the structural properties in benzocyclobutenes and benzocyclobutadienes

Wolfram Koch,  Mirjana Eckert-Maksić,  Zvonimir B. Maksić, 
  • Pages: 319-332
  • First Published: 5 December 1993
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Electronic structure and hyperpolarizability of some conjugated molecules in excited states

Ivo Kanev, 
  • Pages: 333-342
  • First Published: 5 December 1993