| dc.contributor.author | Özen, Alimet Sema | |
| dc.contributor.author | Akdeniz, Zehra | |
| dc.contributor.author | Ruberto, R. | |
| dc.contributor.author | Pastore, G. | |
| dc.contributor.author | Tosi, M. P. | |
| dc.date.accessioned | 2021-06-05T19:56:05Z | |
| dc.date.available | 2021-06-05T19:56:05Z | |
| dc.date.issued | 2014 | |
| dc.identifier.issn | 0375-9601 | |
| dc.identifier.issn | 1873-2429 | |
| dc.identifier.uri | https://doi.org/10.1016/j.physleta.2013.11.040 | |
| dc.identifier.uri | https://hdl.handle.net/20.500.12960/137 | |
| dc.description | 0000-0001-9430-4096 | en_US |
| dc.description | 0000-0002-1307-5349 | en_US |
| dc.description | WOS:000330752300021 | en_US |
| dc.description.abstract | We 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.sponsorship | TUBITAKTurkiye Bilimsel ve Teknolojik Arastirma Kurumu (TUBITAK) | en_US |
| dc.description.sponsorship | Two 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.iso | eng | en_US |
| dc.publisher | Elsevier | en_US |
| dc.relation.ispartof | Physics Letters A | en_US |
| dc.rights | info:eu-repo/semantics/closedAccess | en_US |
| dc.subject | Molecular Trimers | en_US |
| dc.subject | Molten Salts | en_US |
| dc.subject | Tetrahedral Coordination | en_US |
| dc.title | The origins of tetrahedral coordination in molten and glassy ZnCl2 and other group-2B metal dihalides | en_US |
| dc.type | article | en_US |
| dc.department | Denizcilik Fakültesi, Deniz Ulaştırma İşletme Mühendisliği Bölümü | en_US |
| dc.department | Fen Edebiyat Fakültesi, Fizik Bölümü | en_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, Italy | en_US |
| dc.contributor.institutionauthor | Özen, Alimet Sema | |
| dc.contributor.institutionauthor | Akdeniz, Zehra | |
| dc.identifier.doi | 10.1016/j.physleta.2013.11.040 | |
| dc.identifier.volume | 378 | en_US |
| dc.identifier.issue | 4 | en_US |
| dc.identifier.startpage | 431 | en_US |
| dc.identifier.endpage | 433 | en_US |
| dc.relation.publicationcategory | Makale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanı | en_US |
