Ab initio modeling of oxygen impurity atom incorporation into uranium mononitride surface and sub-surface vacancies

Journal of Nuclear Materials

Volumn 416, Issue 1-2, 2011, Pages 200-204

  Bocharov, D ^a,b   Gryaznov, D ^a   Zhukovskii, Yu F ^a   Kotomin, E A ^a  

^a UNIVERSITY OF LATVIA   (Latvia)

^b UNIVERSITY OF LATVIA   (Latvia)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO MODELING; CENTRAL LAYERS; COMPUTER CODES; DENSITY OF STATE; ELECTRONIC CHARGES; MONONITRIDE; OXYGEN ATOM; OXYGEN IMPURITY; OXYGEN IONS; PSEUDOPOTENTIALS; RE-DISTRIBUTION; SLAB MODEL; SUB-SURFACES; URANIUM ATOM;

ATOMS; CALCULATIONS; OXYGEN; URANIUM;

OXYGEN VACANCIES;

EID: 80052917490     PISSN: 00223115     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jnucmat.2010.11.090     Document Type: Article

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