Implications of ab initio energetics on the thermodynamics of Fe-Cr alloys

Simple item page
dc.contributorVirginia Techen
dc.contributor.authorCaro, Alfredoen
dc.contributor.authorCaro, M.en
dc.contributor.authorLopasso, E. M.en
dc.contributor.authorCrowson, D. A.en
dc.contributor.departmentMaterials Science and Engineering (MSE)en
dc.date.accessed2014-03-27en
dc.date.accessioned2014-04-16T14:16:42Zen
dc.date.available2014-04-16T14:16:42Zen
dc.date.issued2006-09-01en
dc.description.abstractThe authors analyze the implications of the recently reported results of ab initio calculations of formation energies of the Fe-Cr alloy. The formation energies show a change in sign from negative to positive as Cr composition increases above similar to 10%. By developing a classic potential to evaluate the thermodynamic properties, they determine the location of the solubility limit and compare it with earlier results. A significant difference appears in a region of temperature and composition that is relevant for the nuclear applications of this alloy. Experimental results seem to confirm the validity of the location of the new solvus line. (c) 2006 American Institute of Physics.en
dc.description.sponsorshipU.S. Department of Energy by the University of California, Lawrence Livermore National Laboratory under Contract No. W-7405-Eng-48en
dc.format.mimetypeapplication/pdfen
dc.identifier.citationCaro, A.; Caro, M.; Lopasso, E. M.; et al., "Implications of ab initio energetics on the thermodynamics of Fe-Cr alloys," Appl. Phys. Lett. 89, 121902 (2006); http://dx.doi.org/10.1063/1.2354445en
dc.identifier.doihttps://doi.org/10.1063/1.2354445en
dc.identifier.issn0003-6951en
dc.identifier.urihttp://hdl.handle.net/10919/47383en
dc.identifier.urlhttp://scitation.aip.org/content/aip/journal/apl/89/12/10.1063/1.2354445en
dc.language.isoen_USen
dc.publisherAIP Publishingen
dc.rightsIn Copyrighten
dc.rights.urihttp://rightsstatements.org/vocab/InC/1.0/en
dc.subjectCU alloysen
dc.subjectIrradiationen
dc.subjectIronen
dc.titleImplications of ab initio energetics on the thermodynamics of Fe-Cr alloysen
dc.title.serialApplied Physics Lettersen
dc.typeArticle - Refereeden
dc.type.dcmitypeTexten

Files

Original bundle
Now showing 1 - 1 of 1
Thumbnail Image
Name:
1.2354445.pdf
Size:
387.07 KB
Format:
Adobe Portable Document Format
Description:
Main article
Download

Collections

Scholarly Works, Materials Science and Engineering (MSE)