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
Stabilization of potential superhard RuO2 phases: A theoretical study
Show others and affiliations
2002 (English)In: Physical Review B. Condensed Matter and Materials Physics, ISSN 1098-0121, E-ISSN 1550-235X, Vol. 66, no 17Article in journal (Refereed) Published
Abstract [en]

First-principles full-potential linear muffin-tin orbital calculations have been used to study RuO2 in the fluorite (CaF2) and rutile structures. An investigation of the effects of metal and nonmetal alloying, oxygen vacancies, and lattice strain on the phase stabilities and electronic structure has been made. From these theoretical results suggestions on how the cubic phase may be stabilized are made. The pressure induced phase transitions between the rutile, CaCl2, Pa3 and fluorite phases and the bulk moduli of several 4d and 5d transition metal dioxides have also been studied.

Place, publisher, year, edition, pages
2002. Vol. 66, no 17
Keyword [en]
transition-metal dioxides, high-pressure, molybdenum carbide, rutile dioxides, stabilities, mechanism, diamond, model, iro2
Identifiers
URN: urn:nbn:se:kth:diva-22101ISI: 000179611700032OAI: oai:DiVA.org:kth-22101DiVA: diva2:340799
Note
QC 20100525Available from: 2010-08-10 Created: 2010-08-10 Last updated: 2017-12-12Bibliographically approved

Open Access in DiVA

No full text

Authority records BETA

Hugosson, Håkan Wilhelm

Search in DiVA

By author/editor
Hugosson, Håkan Wilhelm
In the same journal
Physical Review B. Condensed Matter and Materials Physics

Search outside of DiVA

GoogleGoogle Scholar

urn-nbn

Altmetric score

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