Formation energies of point defects at finite temperatures
- Author
- GRABOWSKI, B1 ; HICKEL, T1 ; NEUGEBAUER, J1
[1] Max-Planck-Institut fur Eisenforschung GmbH, 40237 Dusseldorf, Germany - Source
Physica status solidi. B. Basic research. 2011, Vol 248, Num 6, pp 1295-1308, 14 p ; ref : 56 ref
- CODEN
- PSSBBD
- ISSN
- 0370-1972
- Scientific domain
- Crystallography; Electronics; Nanotechnologies, nanostructures, nanoobjects; Condensed state physics
- Publisher
- Wiley-VCH, Berlin
- Publication country
- Germany
- Document type
- Article
- Language
- English
- Keyword (fr)
- Aluminium Anharmonicité Approximation Born Oppenheimer Calcul ab initio Chaleur formation Densité défaut Défaut ponctuel Energie libre Formation défaut Lacune Mode vibration Entropie configurationnelle
- Keyword (en)
- Aluminium Anharmonicity Born-Oppenheimer approximation Ab initio calculations Heat of formation Defect density Point defects Free energy Defect formation Vacancies Vibrational modes Configuration entropy
- Keyword (es)
- Densidad defecto Formación defecto
- Classification
- Pascal
- 001 Exact sciences and technology / 001B Physics / 001B60 Condensed matter: structure, mechanical and thermal properties / 001B60A Structure of solids and liquids; crystallography / 001B60A72 Defects and impurities in crystals; microstructure / 001B60A72J Point defects (vacancies, interstitials, color centers, etc.) and defect clusters
- Discipline
- Physics of condensed state : structure, mechanical and thermal properties
- Origin
- Inist-CNRS
- Database
- PASCAL
- INIST identifier
- 24203970
Sauf mention contraire ci-dessus, le contenu de cette notice bibliographique peut être utilisé dans le cadre d’une licence CC BY 4.0 Inist-CNRS / Unless otherwise stated above, the content of this bibliographic record may be used under a CC BY 4.0 licence by Inist-CNRS / A menos que se haya señalado antes, el contenido de este registro bibliográfico puede ser utilizado al amparo de una licencia CC BY 4.0 Inist-CNRS
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DOI
10.1002/pssb.201046302 
https://dx.doi.org/10.1002/pssb.201046302
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