First-Principles Study of Structural, Electronic and Optical Properties in BaTi0.5Ni0.5O3
2013 ◽
Vol 834-836
◽
pp. 268-271
Keyword(s):
The pseudo-potential plane wave (PP-PW) mehod with the generalized gradient approximation (GGA) is applied to study the electronic and optical properties of BaTi0.5Ni0.5O3. The energy band structure, density of states (DOS) are obtained. The optical properties including the dielectric function, reflectivity, absorption spectrum, extinction coefficient, energy-loss spectrum and refractive index are also calculated and analyzed in detail.
2013 ◽
Vol 846-847
◽
pp. 1919-1922
2013 ◽
Vol 846-847
◽
pp. 1923-1926
2012 ◽
Vol 476-478
◽
pp. 1154-1158
2012 ◽
Vol 490-495
◽
pp. 3253-3256
◽
2013 ◽
Vol 760-762
◽
pp. 425-428
2016 ◽
Vol 30
(14)
◽
pp. 1650077
◽
2015 ◽
Vol 32
(9)
◽
pp. 096102
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