Non-stoichiometry in MgAl2O4 spinel

Philosophical Magazine

Volumn 90, Issue 10, 2010, Pages 1297-1305

  Murphy, S T ^a   Gilbert, C A ^b   Smith, R ^b   Mitchell, T E ^c   Grimes, R W ^a  

^a IMPERIAL COLLEGE LONDON   (United Kingdom)

^b LOUGHBOROUGH UNIVERSITY   (United Kingdom)

^c LOS ALAMOS NATIONAL LABORATORY   (United States)

Author keywords

Atomistic simulation; Defect structures; Non stoichiometry; Spinel

Indexed keywords

ATOMISTIC SIMULATION; ATOMISTIC SIMULATIONS; CATION VACANCIES; DEFECT CHEMISTRY; INTERSTITIAL DEFECTS; LOWER ENERGIES; MAGNESIUM ALUMINATE SPINEL; NON-STOICHIOMETRY; QUANTUM MECHANICAL; STOICHIOMETRIC COMPOSITIONS;

ALUMINUM; DEFECTS; DENSITY FUNCTIONAL THEORY; MAGNESIUM; OXYGEN; OXYGEN VACANCIES; QUANTUM THEORY; STOICHIOMETRY; VACANCIES;

DEFECT DENSITY;

EID: 77951165901     PISSN: 14786435     EISSN: 14786443     Source Type: Journal    
DOI: 10.1080/14786430903341402     Document Type: Article

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