Electronic, magnetic and optical properties of β-Ti3O 5 and λ-Ti3O5: A density functional study

Computational Materials Science

Volumn 81, Issue , 2014, Pages 158-162

  Liu, Rui ^a   Shang, Jia Xiang ^a   Wang, Fu He ^b  

^a BEIHANG UNIVERSITY   (China)

^b CAPITAL NORMAL UNIVERSITY   (China)

Author keywords

Density functional theory; Electronic property; Optical properties; Ti3O5

Indexed keywords

COULOMB CORRECTIONS; DENSITY-FUNCTIONAL STUDY; DIELECTRIC FUNCTIONS; ELECTRONIC INTERACTIONS; IMAGINARY PARTS; MAGNETIC AND OPTICAL PROPERTIES; METAL-SEMICONDUCTOR PHASE TRANSITION; POTENTIAL MATERIALS;

ABSORPTION SPECTROSCOPY; DENSITY FUNCTIONAL THEORY; ELECTRONIC PROPERTIES; MAGNETIC MOMENTS; OPTICAL PROPERTIES; REFRACTIVE INDEX;

ATOMS;

EID: 84888299109     PISSN: 09270256     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.commatsci.2013.08.001     Document Type: Article

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