A systematic study of ideal and double layer reconstructions of ABO 3(001) surfaces (A = Sr, Ba; B = Ti, Zr) from first principles

Journal of Physics Condensed Matter

Volumn 22, Issue 30, 2010, Pages

  Iles, N ^a,b   Finocchi, F ^a   Driss Khodja, K ^b  

^a INSTITUT DES NANOSCIENCES DE PARIS   (France)

^b UNIVERSITY OF ORAN   (Algeria)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMIC STRUCTURE; CHARGE REDISTRIBUTION; COMPARATIVE STUDIES; DOUBLE LAYERS; FIRST-PRINCIPLES; NEUTRAL SURFACES; SRTIO; SRZRO; STABILITY DOMAINS; STRESS RELEASE; SYSTEMATIC STUDY; THERMODYNAMICALLY STABLE;

BARIUM; DENSITY FUNCTIONAL THEORY; ELECTRIC FIELDS; ZIRCONIUM;

REPAIR;

EID: 77954336604     PISSN: 09538984     EISSN: 1361648X     Source Type: Journal    
DOI: 10.1088/0953-8984/22/30/305001     Document Type: Article

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