Vibrational thermodynamics: coupling of chemical order and size effects

Please use this identifier to cite or link to this item: http://dspace.mediu.edu.my:8181/xmlui/handle/1721.1/3992

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DC Field	Value	Language
dc.creator	van de Walle, Axel	-
dc.creator	Morgan, Dane	-
dc.creator	Wu, Eric	-
dc.creator	Ceder, Gerbrand	-
dc.date	2003-12-22T21:03:08Z	-
dc.date	2003-12-22T21:03:08Z	-
dc.date	2002-01	-
dc.date.accessioned	2013-10-09T02:33:28Z	-
dc.date.available	2013-10-09T02:33:28Z	-
dc.date.issued	2013-10-09	-
dc.identifier	http://hdl.handle.net/1721.1/3992	-
dc.identifier.uri	http://koha.mediu.edu.my:8181/xmlui/handle/1721	-
dc.description	We study the effects of vibrations in the Pd₃ system using first-principles pseudopotential calculations. We find that upon disordering from the DO₂₂ phase, the decreases by 0.07kB. We explain our results in terms of atomic relaxations and size effects.	-
dc.description	Singapore-MIT Alliance (SMA)	-
dc.format	163297 bytes	-
dc.format	application/pdf	-
dc.language	en_US	-
dc.relation	Advanced Materials for Micro- and Nano-Systems (AMMNS);	-
dc.subject	Pd3V	-
dc.subject	first-principles pseudopotential calculations	-
dc.subject	vibrational thermodynamics	-
dc.subject	size effects	-
dc.title	Vibrational thermodynamics: coupling of chemical order and size effects	-
dc.type	Article	-
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