Change search
ReferencesLink to record
Permanent link

Direct link
Monovacancy formation energies and Fermi surface topological transitions in Pd-Ag alloys
KTH, School of Industrial Engineering and Management (ITM), Materials Science and Engineering.
KTH, School of Industrial Engineering and Management (ITM), Materials Science and Engineering, Applied Material Physics.ORCID iD: 0000-0003-2832-3293
2015 (English)In: Physical Review B. Condensed Matter and Materials Physics, ISSN 1098-0121, E-ISSN 1550-235X, Vol. 92, no 22, 224107Article in journal (Refereed) PublishedText
Abstract [en]

Using first-principles mean-field alloy theory, we calculate the vacancy formation energies of the face-centered-cubic Pd-Ag alloys as a function of chemical composition. The effect of Fermi surface topological transition on the composition dependence of the vacancy formation energies is detectable and is consistent with what has previously been shown for the bulk properties of Pd1-xAgx.

Place, publisher, year, edition, pages
American Physical Society , 2015. Vol. 92, no 22, 224107
National Category
Physical Sciences
Identifiers
URN: urn:nbn:se:kth:diva-180217DOI: 10.1103/PhysRevB.92.224107ISI: 000366085900003ScopusID: 2-s2.0-84950349682OAI: oai:DiVA.org:kth-180217DiVA: diva2:895622
Note

QC 20160119

Available from: 2016-01-19 Created: 2016-01-08 Last updated: 2016-01-21Bibliographically approved

Open Access in DiVA

No full text

Other links

Publisher's full textScopus

Search in DiVA

By author/editor
Delczeg, LorandVitos, Levente
By organisation
Materials Science and EngineeringApplied Material Physics
In the same journal
Physical Review B. Condensed Matter and Materials Physics
Physical Sciences

Search outside of DiVA

GoogleGoogle Scholar
The number of downloads is the sum of all downloads of full texts. It may include eg previous versions that are now no longer available

Altmetric score

Total: 19 hits
ReferencesLink to record
Permanent link

Direct link