Change search
CiteExportLink to record
Permanent link

Direct link
Cite
Citation style
  • apa
  • harvard1
  • ieee
  • modern-language-association-8th-edition
  • vancouver
  • Other style
More styles
Language
  • de-DE
  • en-GB
  • en-US
  • fi-FI
  • nn-NO
  • nn-NB
  • sv-SE
  • Other locale
More languages
Output format
  • html
  • text
  • asciidoc
  • rtf
Theory of the ternary layered system Ti-Al-N
KTH, Superseded Departments, Materials Science and Engineering.
2002 (English)In: Journal of Applied Physics, ISSN 0021-8979, E-ISSN 1089-7550, Vol. 91, no 12, 9874-9877 p.Article in journal (Refereed) Published
Abstract [en]

We present calculations on the physical properties of Ti4AlN3 obtained from first principles, as well as some general observations concerning this group of materials. We further report mechanical data obtained through numerical simulations for some representative phases, and elaborate on the issue of high pressure stability. By examining the density of states of Ti4AlN3, we conclude that it is a semimetal, and we predict an opening up of the band gap around the Fermi level with increasing pressure.

Place, publisher, year, edition, pages
2002. Vol. 91, no 12, 9874-9877 p.
Keyword [en]
initio molecular-dynamics, ti3sic2, transition, ti4aln3, nitride, pseudopotentials
Identifiers
URN: urn:nbn:se:kth:diva-21585DOI: 10.1063/1.1476076ISI: 000175905200061OAI: oai:DiVA.org:kth-21585DiVA: diva2:340283
Note
QC 20100525Available from: 2010-08-10 Created: 2010-08-10 Last updated: 2017-12-12Bibliographically approved

Open Access in DiVA

No full text

Other links

Publisher's full text

Search in DiVA

By author/editor
Ahuja, RajeevJohansson, Börje
By organisation
Materials Science and Engineering
In the same journal
Journal of Applied Physics

Search outside of DiVA

GoogleGoogle Scholar

doi
urn-nbn

Altmetric score

doi
urn-nbn
Total: 21 hits
CiteExportLink to record
Permanent link

Direct link
Cite
Citation style
  • apa
  • harvard1
  • ieee
  • modern-language-association-8th-edition
  • vancouver
  • Other style
More styles
Language
  • de-DE
  • en-GB
  • en-US
  • fi-FI
  • nn-NO
  • nn-NB
  • sv-SE
  • Other locale
More languages
Output format
  • html
  • text
  • asciidoc
  • rtf