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materials science, multidisciplinary (113) 113
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Journal of Luminescence, ISSN 0022-2313, 01/2013, Volume 133, pp. 69 - 72
A review of the optical properties of Mn ions in a number of host lattices is presented. As an example, detailed crystal field calculations of the Mn energy... 
Luminescence | Crystal field | Nephelauxetic effect
Journal Article
Physica B: Condensed Matter, ISSN 0921-4526, 03/2018, Volume 532, pp. 178 - 183
Journal Article
Journal of Solid State Chemistry, ISSN 0022-4596, 04/2014, Volume 212, p. 37
Journal Article
Journal of Solid State Chemistry, ISSN 0022-4596, 04/2014, Volume 212
The structural, electronic, and optical properties of a recently synthesized thorium compound Rb{sub 2}Th{sub 7}Se{sub 15} have been calculated in the density... 
DENSITY | DENSITY FUNCTIONAL METHOD | WAVELENGTHS | INORGANIC, ORGANIC, PHYSICAL AND ANALYTICAL CHEMISTRY | EV RANGE | IONS | THORIUM COMPOUNDS
Journal Article
Journal of Luminescence, ISSN 0022-2313, 2012, Volume 132, Issue 3, pp. 579 - 584
A detailed study using the ab initio DFT-based calculations of the electronic and optical properties of pure and Mn doped Ba LaNbO is presented in this paper.... 
Ba 2LaNbO 6 | Perovskite | Mn 4 | Ab initio DFT based calculations | Energy level scheme | LaNbO
Journal Article
Journal of Alloys and Compounds, ISSN 0925-8388, 08/2016, Volume 675, p. 355
Complex first-order linear optical dispersion and complex second-order non-linear optical dispersion of LiInX.sub.2 (X = Se, Te) chalcopyrite single crystals... 
Anisotropy | Analysis | Green technology | Density functionals | Methods
Journal Article
ECS Journal of Solid State Science and Technology, ISSN 2162-8769, 2015, Volume 4, Issue 3, pp. R39 - R43
Journal Article
Chemistry of Materials, ISSN 0897-4756, 04/2015, Volume 27, Issue 8, pp. 2938 - 2945
Journal Article
Optical Materials, ISSN 0925-3467, 01/2017, Volume 63, pp. 207 - 212
Journal Article
Optical Materials, ISSN 0925-3467, 01/2017, Volume 63, p. 207
In this paper we report on the spectroscopic properties of Mn.sup.4+ (3d.sup.3) ion in the orthorhombic perovskite, GdAlO.sub.3 and calculate the energy levels... 
Perovskite | Analysis
Journal Article
Solid State Communications, ISSN 0038-1098, 12/2011, Volume 151, Issue 23, p. 1733
Journal Article
Journal of Alloys and Compounds, ISSN 0925-8388, 02/2011, Volume 509, Issue 5, pp. 1452 - 1456
The spectroscopic properties of a series of red phosphors with general composition of CaAl O :yMn and (Ca Al O , xMgO):yMn (x = 0-1, y = 0.001-1.5%)... 
Crystal field modeling | Photoluminescence | Red phosphor
Journal Article
Optical Materials, ISSN 0925-3467, 04/2016, Volume 54, p. 245
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Journal Article
Optical Materials, ISSN 0925-3467, 04/2016, Volume 54, pp. 245 - 251
Journal Article
Journal of Physics and Chemistry of Solids, ISSN 0022-3697, 02/2012, Volume 73, Issue 2, p. 252
The structural, electronic, optical and elastic properties of the cubic double perovskite Ba.sub.2MgWO.sub.6 were calculated using the ab initio plane wave... 
Perovskite | Anisotropy | Analysis | Crystals | Structure
Journal Article
Optical Materials, ISSN 0925-3467, 12/2012, Volume 35, Issue 2, pp. 196 - 200
The excitation spectra of the six-coordinated Mn ion in the pyrochlores Ln Sn O (Ln = Lu , Y , and Gd ) have been determined to examine the variation in the... 
Pyrochlore | Covalence | Sn,Ti | Crystalline field strength
Journal Article
Journal of Physics and Chemistry of Solids, ISSN 0022-3697, 2012, Volume 73, Issue 2, pp. 252 - 256
The structural, electronic, optical and elastic properties of the cubic double perovskite Ba MgWO were calculated using the plane wave method and compared with... 
A. Inorganic compounds | D. Elastic properties | D. Electronic structure | C. Ab initio calculations
Journal Article
Physica B: Physics of Condensed Matter, ISSN 0921-4526, 03/2018, Volume 532, pp. 178 - 183
The structural and electronic properties of pure and Ti -doped α-Al O were calculated in the present paper by using the first-principles methods. Special... 
Al2O3:Ti3 | First-principles calculations | Crystal field effects | Electronic structure | Ti | SAPPHIRE | PHYSICS, CONDENSED MATTER | X-RAY-DIFFRACTION | 1ST PRINCIPLES | ALPHA-AL2O3 | TRANSITION | PRESSURE | SINGLE-CRYSTAL | SPECTROSCOPY | AL2O3-TI3 | RUBY
Journal Article
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