Odhalení vlivu kompresního mechanismu na elektronovou strukturu a související vlastnosti CrF3
| dc.contributor.author | Al-Jaary, Ali H. Reshak | |
| dc.date.accessioned | 2017-05-17T11:06:30Z | |
| dc.date.available | 2017-05-17T11:06:30Z | |
| dc.date.issued | 2016 | |
| dc.description.abstract | Vliv kompresního mechanismu na elementární buňky CrF3 je zkoumán pomocí funkční teorie hustoty. Experimentální parametry mřížky pod různými hodnotami tlaku, a to od běžného tlaku až do 9.12 GPa byly optimalizovány tak, aby došlo k uvolnění krystalických struktur. | cs |
| dc.description.abstract-translated | The influence of the compression mechanism on the unit cell of CrF3 is investigated by means of density functional theory. The experimental lattice parameters under different pressure values starting from the ambient pressure up to 9.12 GPa were optimized so as to relax the crystalline structures. | en |
| dc.format | 10 s. | cs |
| dc.format.mimetype | application/pdf | |
| dc.identifier.citation | AL-JAARY, Ali H. Reshak Revealing the influence of the compression mechanism on the electronic structure and the related properties of CrF3. Journal of Alloys and Compounds, 2016, roč. 660, č. MAR 5 2016, s. 1-10. ISSN 0925-8388. | en |
| dc.identifier.doi | 10.1016/j.jallcom.2015.11.035 | |
| dc.identifier.issn | 0925-8388 | |
| dc.identifier.obd | 43917977 | |
| dc.identifier.uri | http://hdl.handle.net/11025/26003 | |
| dc.identifier.uri | https://www.scopus.com/record/display.uri?origin=resultslist&eid=2-s2.0-84947914332 | |
| dc.identifier.uri | http://apps.webofknowledge.com/InboundService.do?mode=FullRecord&customersID=Alerting&IsProductCode=Yes&product=WOS&Init=Yes&Func=Frame&DestFail=http%3A%2F%2Fwww.webofknowledge.com&action=retrieve&SrcApp=Alerting&SrcAuth=Alerting&SID=U1wnLaUtaTrKMC1Crfb&UT=WOS%3A000366944300001 | |
| dc.identifier.uri | 2-s2.0-84947914332 | |
| dc.identifier.uri | 000366944300001 | |
| dc.language.iso | en | en |
| dc.publisher | Elsevier | en |
| dc.rights | Plný text není přístupný. | cs |
| dc.rights | © Elsevier | en |
| dc.rights.access | closedAccess | en |
| dc.subject | okolní tlak | cs |
| dc.subject | vysoký tlak | cs |
| dc.subject | kmen | cs |
| dc.subject | CrF3 | cs |
| dc.subject | DFT | cs |
| dc.subject | optické vlastnosti | cs |
| dc.subject.translated | ambient pressure | en |
| dc.subject.translated | high pressure | en |
| dc.subject.translated | strain | en |
| dc.subject.translated | CrF3 | en |
| dc.subject.translated | DFT | en |
| dc.subject.translated | optical properties | en |
| dc.title | Odhalení vlivu kompresního mechanismu na elektronovou strukturu a související vlastnosti CrF3 | cs |
| dc.title | Revealing the influence of the compression mechanism on the electronic structure and the related properties of CrF3 | en |
| dc.type | článek | cs |
| dc.type | article | en |
| dc.type.status | Peer-reviewed | en |
| dc.type.version | publishedVersion | en |
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