Sökning: id:"swepub:oai:DiVA.org:kth-23222" >
Ab initio phonon ca...
Ab initio phonon calculations for Ll(2) Ni3Al and B2NiAl
-
- Isaeva, E. I. (författare)
- Theoretical Physics Department, Moscow Stt. Inst. Steel and Alloys, 4, Leninskii Prospect, Moscow 119049, Russian Federation
-
- Abrikosov, Igor (författare)
- Linköpings universitet,Tekniska högskolan,Teoretisk Fysik
-
- Vekilov, Y. K. (författare)
- Theoretical Physics Department, Moscow Stt. Inst. Steel and Alloys, 4, Leninskii Prospect, Moscow 119049, Russian Federation
-
visa fler...
-
- Smirnova, E. A. (författare)
- Theoretical Physics Department, Moscow Stt. Inst. Steel and Alloys, 4, Leninskii Prospect, Moscow 119049, Russian Federation
-
Abrikosov, I. A. (författare)
-
- Simak, S. I. (författare)
- Condensed Matter Theory Group, Uppsala University, SE-751 21 Uppsala, Sweden
-
- Ahuja, Rajeev (författare)
- KTH,Materialvetenskap,Condensed Matter Theory Group, Uppsala University, SE-751 21 Uppsala, Sweden
-
- Johansson, Börje (författare)
- KTH,Materialvetenskap,Condensed Matter Theory Group, Uppsala University, SE-751 21 Uppsala, Sweden, Dept. of Mat. Sci. and Engineering, Royal Institute of Technology (KTH), SE-100 44 Stockholm, Sweden
-
visa färre...
-
Theoretical Physics Department, Moscow Stt Inst. Steel and Alloys, 4, Leninskii Prospect, Moscow 119049, Russian Federation Tekniska högskolan (creator_code:org_t)
- Elsevier BV, 2004
- 2004
- Engelska.
-
Ingår i: Solid State Communications. - : Elsevier BV. - 0038-1098 .- 1879-2766. ; 129:12, s. 809-814
- Relaterad länk:
-
https://urn.kb.se/re...
-
visa fler...
-
https://doi.org/10.1...
-
https://urn.kb.se/re...
-
visa färre...
Abstract
Ämnesord
Stäng
- The phonon spectra and phonon density of states of the Ni3Al and NiAl intermetallic compounds are calculated from first principles using the linear response method in conjunction with ultrasoft pseudopotentials. The calculated phonon dispersion curves are in good agreement with available experimental results from inelastic neutron scattering.
Nyckelord
- intermetallic compounds
- phonons
- lattice-dynamics
- electronic-structure
- neutron-scattering
- martensitic-transformation
- thermodynamic properties
- abinitio
- calculation
- thermal-properties
- force-constants
- nial alloys
- al
- TECHNOLOGY
Publikations- och innehållstyp
- ref (ämneskategori)
- art (ämneskategori)
Hitta via bibliotek
Till lärosätets databas