Crystal structure and ab initio calculations of CaZrO3

Journal of the European Ceramic Society

Volumn 32, Issue 3, 2012, Pages 665-670

  Stoch, P ^a   Szczerba, J ^a   Lis, J ^a   Madej, D ^a   Peogonekdzich, Z ^a  

^a AGH UNIVERSITY OF SCIENCE AND TECHNOLOGY   (Poland)

Author keywords

Ab initio; Arc melting; CaZrO3; Crystal structure; Electronic structure; Perovskite; Refractory

Indexed keywords

AB INITIO; AB INITIO CALCULATIONS; ALKALI OXIDE; ARC-MELTING; BULK DENSITY; CALCIUM ZIRCONATE; CAZRO3; COVALENT CHARACTER; EDS ANALYSIS; ELECTRIC ARC MELTING; ENERGY BANDGAPS; EXCELLENT CORROSION RESISTANCES; FULL-POTENTIAL LINEAR AUGMENTED PLANE WAVES; HIGH MELTING POINT; HIGH POROSITY; HIGH STRENGTH; LOW THERMAL EXPANSION; PEROVSKITE LIKE STRUCTURE; POTENTIAL APPLICATIONS; REFRACTORY; SCANNING ELECTRON MICROSCOPE; STRUCTURE PARAMETER; SYNTHESIS METHOD; SYNTHESIZED MATERIALS; X RAY MEASUREMENTS;

CALCULATIONS; CORROSION RESISTANCE; ELECTRIC ARCS; ELECTRONIC STRUCTURE; PEROVSKITE; PHASE TRANSITIONS; REFRACTORY MATERIALS; SCANNING ELECTRON MICROSCOPY; STOICHIOMETRY; STRENGTH OF MATERIALS; SYNTHESIS (CHEMICAL); THERMAL EXPANSION; ZIRCONIUM;

CRYSTAL STRUCTURE;

EID: 82155166325     PISSN: 09552219     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jeurceramsoc.2011.10.011     Document Type: Article

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