Structure and Spectroscopy of Cr3+ Defects in KMgF3, KZnF3, and CsCaF3 Crystals. An Ab Initio Model Potential Embedded Cluster Study

International Journal of Quantum Chemistry

Volumn 77, Issue 6, 2000, Pages 961-972

  López Moraza, Sara ^a   Seijo, Luis ^a   Barandiarán, Zoila ^a  

^a UNIVERSIDAD AUTÓNOMA DE MADRID   (Spain)

Author keywords

Ab initio model potential; Cr3+ defects; Embedded cluster; Fluoroperovskites; Spectroscopy

Indexed keywords

EID: 0038373271     PISSN: 00207608     EISSN: None     Source Type: Journal    
DOI: 10.1002/(SICI)1097-461X(2000)77:6<961::AID-QUA4>3.0.CO;2-A     Document Type: Article

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