Optical and vibrational properties of MnF64- complexes in cubic fluoroperovskites: Insight through embedding calculations using Kohn-Sham equations with constrained electron density

Journal of Physics Condensed Matter

Volumn 18, Issue 5, 2006, Pages 1519-1534

  Garcia Lastra J M ^a   Wesolowski, T ^b   Barriuso, M T ^a   Aramburu, J A ^a   Moreno, M ^a  

^a UNIVERSITY OF CANTABRIA   (Spain)

^b UNIVERSITY OF GENEVA   (Switzerland)

Author keywords

[No Author keywords available]

Indexed keywords

CARRIER CONCENTRATION; CHEMICAL BONDS; DOPING (ADDITIVES); HYDROSTATIC PRESSURE; MOLECULAR STRUCTURE; NATURAL FREQUENCIES; OPTICAL PROPERTIES;

FLUOROPEROVSKITES; HUANG-RHYS FACTORS; KOHN-SHAM EQUATIONS; VIBRATIONAL PROPERTIES;

PEROVSKITE;

EID: 31144474620     PISSN: 09538984     EISSN: 1361648X     Source Type: Journal    
DOI: 10.1088/0953-8984/18/5/004     Document Type: Article

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