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High-pressure structural behavior of the double perovskite Sr2CrReO6: an experimental and theoretical study
KTH, School of Industrial Engineering and Management (ITM), Materials Science and Engineering.
KTH, School of Industrial Engineering and Management (ITM), Materials Science and Engineering.
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2009 (English)In: High Pressure Research, ISSN 0895-7959, E-ISSN 1477-2299, Vol. 29, no 1, 83-86 p.Article in journal (Refereed) Published
Abstract [en]

The high-pressure structural behavior of Sr2CrReO6 has been studied experimentally using synchrotron radiation and the diamond anvil cell and theoretically using density functional theory. The experimental zero-pressure bulk modulus is B0=1704GPa and the pressure derivative is B0'=4.71.0. These results compare well with the calculated values 172.6GPa and 5.7. A pseudo-cubic unit cell can describe the crystal structure at low pressure, but the tetragonal structure becomes evident at high pressure.

Place, publisher, year, edition, pages
2009. Vol. 29, no 1, 83-86 p.
Keyword [en]
bulk modulus, equation of state, phase transformation, X-ray diffraction, density functional theory, double perovskite Sr2CrReO6
National Category
Materials Engineering
Identifiers
URN: urn:nbn:se:kth:diva-31236DOI: 10.1080/08957950802429045ISI: 000264375400016Scopus ID: 2-s2.0-68349116036OAI: oai:DiVA.org:kth-31236DiVA: diva2:405859
Note
QC 20110324 46th Annual Meeting of the European-High-Pressure-Research-Group Meeting (EHPRG 46), Valencia, SPAIN, SEP 07-12, 2008Available from: 2011-03-24 Created: 2011-03-11 Last updated: 2017-12-11Bibliographically approved

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