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dc.contributor.authorÖzen, Alimet Sema
dc.contributor.authorAkdeniz, Zehra
dc.contributor.authorRuberto, R.
dc.contributor.authorPastore, G.
dc.contributor.authorTosi, M. P.
dc.date.accessioned2021-06-05T19:56:05Z
dc.date.available2021-06-05T19:56:05Z
dc.date.issued2014
dc.identifier.issn0375-9601
dc.identifier.issn1873-2429
dc.identifier.urihttps://doi.org/10.1016/j.physleta.2013.11.040
dc.identifier.urihttps://hdl.handle.net/20.500.12960/137
dc.description0000-0001-9430-4096en_US
dc.description0000-0002-1307-5349en_US
dc.descriptionWOS:000330752300021en_US
dc.description.abstractWe report the results of first-principles calculations carried out within a relativistic density-functional method, on the molecular trimers of the MX2 compounds (with M = Zn or Cd and X = Cl, Br, or I), showing how a distorted tetrahedral coordination of a group-2B metal atom by halogens first arises. The trimers of HgX2 are also discussed, both in unstable and in stable configurations. (C) 2013 Elsevier B.V. All rights reserved.en_US
dc.description.sponsorshipTUBITAKTurkiye Bilimsel ve Teknolojik Arastirma Kurumu (TUBITAK)en_US
dc.description.sponsorshipTwo of us (A.S.O. and Z.A.) acknowledge support from TUBITAK. M.P.T. and Z.A. thank for their hospitality the Condensed Matter and Statistical Physics Section of the Abdus Sa lam. International Center for Theoretical Physics in Trieste.en_US
dc.language.isoengen_US
dc.publisherElsevieren_US
dc.relation.ispartofPhysics Letters Aen_US
dc.rightsinfo:eu-repo/semantics/closedAccessen_US
dc.subjectMolecular Trimersen_US
dc.subjectMolten Saltsen_US
dc.subjectTetrahedral Coordinationen_US
dc.titleThe origins of tetrahedral coordination in molten and glassy ZnCl2 and other group-2B metal dihalidesen_US
dc.typearticleen_US
dc.departmentDenizcilik Fakültesi, Deniz Ulaştırma İşletme Mühendisliği Bölümüen_US
dc.departmentFen Edebiyat Fakültesi, Fizik Bölümüen_US
dc.department-temp[Ozen, A. S.; Akdeniz, Z.] Piri Reis Univ, Fac Sci & Letters, TR-34940 Istanbul, Turkey; [Ruberto, R.] cNISM, I-98166 Messina, Italy; [Ruberto, R.] Dipartimento Fis Univ, I-98166 Messina, Italy; [Pastore, G.] Dipartimento Fis Univ, I-34151 Trieste, Italy; [Pastore, G.] cNR IOM, I-34151 Trieste, Italy; [Tosid, M. P.] Scuola Normale Super Pisa, I-56126 Pisa, Italyen_US
dc.contributor.institutionauthorÖzen, Alimet Sema
dc.contributor.institutionauthorAkdeniz, Zehra
dc.identifier.doi10.1016/j.physleta.2013.11.040
dc.identifier.volume378en_US
dc.identifier.issue4en_US
dc.identifier.startpage431en_US
dc.identifier.endpage433en_US
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanıen_US


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