THE M6S8L6 CLUSTERS - AN EXAMPLE IN CLUSTER AND CONDENSED-PHASE CHEMISTRY

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dc.contributor.authorARRATIA-PEREZ, R
dc.date.accessioned2025-01-23T19:21:37Z
dc.date.available2025-01-23T19:21:37Z
dc.date.issued1993
dc.description.abstractDirac molecular orbital calculations (DSW-Xalpha) on the octahedral molecular cluster models M6S8L6 (M=Mo, W; and L=two-electron ligand sigma donor) have been carried out. The calculated cluster valence density of states, valence bandwidth and calculated formal charge on each Mo atom, and calculated outer core spin-orbit parameters of the metal and S-facial atoms are in good accord with resolved XPS and UPS data of the molecular clusters Mo6S8 (PEt3) 6, W6S8 (PEt3)6, and of the solid AMo6S8 (A = Pb, Sn) superconducting ternary phases.
dc.fuente.origenWOS
dc.identifier.issn0009-2614
dc.identifier.urihttps://repositorio.uc.cl/handle/11534/98819
dc.identifier.wosidWOS:A1993MB41700021
dc.issue.numero5-6
dc.language.isoen
dc.pagina.final553
dc.pagina.inicio547
dc.revistaChemical physics letters
dc.rightsacceso restringido
dc.titleTHE M6S8L6 CLUSTERS - AN EXAMPLE IN CLUSTER AND CONDENSED-PHASE CHEMISTRY
dc.typeartículo
dc.volumen213
sipa.indexWOS
sipa.trazabilidadWOS;2025-01-12
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