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Theoretical ab initio study of the intrinsic band gap in semiconductor oxides based on modified titanium dioxides
Theoretical Chemistry Accounts
◽
10.1007/s00214-005-0666-8
◽
2005
◽
Vol 114
(1-3)
◽
pp. 235-241
◽
Cited By ~ 9
Author(s):
Nurbosyn U. Zhanpeisov
◽
Masakazu Anpo
Keyword(s):
Ab Initio
◽
Band Gap
◽
Ab Initio Study
◽
Semiconductor Oxides
◽
Titanium Dioxides
Download Full-text
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References
Direct band gap halide-double-perovskite absorbers for solar cells and light emitting diodes: Ab initio study of bulk and layers
Physical Review Materials
◽
10.1103/physrevmaterials.5.095401
◽
2021
◽
Vol 5
(9)
◽
Author(s):
Anu Bala
◽
Vijay Kumar
Keyword(s):
Solar Cells
◽
Ab Initio
◽
Band Gap
◽
Light Emitting Diodes
◽
Double Perovskite
◽
Ab Initio Study
◽
Light Emitting
◽
Direct Band Gap
◽
Direct Band
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Ab initio study of band gap properties in metastable BC8/ST12 SixGe1−x alloys
Applied Physics Letters
◽
10.1063/5.0010311
◽
2020
◽
Vol 117
(3)
◽
pp. 032105
Author(s):
J. Wagner
◽
M. Núñez-Valdez
Keyword(s):
Ab Initio
◽
Band Gap
◽
Ab Initio Study
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Ab initio study of tunable band gap of monolayer and bilayer phosphorene by the vertical electronic field
Journal of Wuhan University of Technology-Mater Sci Ed
◽
10.1007/s11595-017-1582-1
◽
2017
◽
Vol 32
(1)
◽
pp. 213-216
◽
Cited By ~ 2
Author(s):
Tao Wang
◽
Wei Guo
◽
Luowei Wen
◽
Yan Liu
◽
Bin Zhang
◽
...
Keyword(s):
Ab Initio
◽
Band Gap
◽
Ab Initio Study
◽
Electronic Field
◽
Tunable Band Gap
Download Full-text
Ab initio study of structural phase transformations and band gap of chalcopyrite phase in AgInTe2 under high pressure
Solid State Communications
◽
10.1016/j.ssc.2015.07.002
◽
2015
◽
Vol 220
◽
pp. 25-30
◽
Cited By ~ 2
Author(s):
K. Kotmool
◽
T. Bovornratanaraks
◽
K. Yoodee
Keyword(s):
High Pressure
◽
Ab Initio
◽
Phase Transformations
◽
Band Gap
◽
Structural Phase
◽
Ab Initio Study
◽
Structural Phase Transformations
Download Full-text
Intrinsic band gap in semiconductor oxides and Ti-silicalite: ab initio and DFT study
Research on Chemical Intermediates
◽
10.1163/156856704322798106
◽
2004
◽
Vol 30
(1)
◽
pp. 121-132
◽
Cited By ~ 7
Author(s):
N. U. Zhanpeisov
◽
K. Tsujimaru
◽
M. Anpo
Keyword(s):
Ab Initio
◽
Band Gap
◽
Dft Study
◽
Semiconductor Oxides
◽
Ab Initio And Dft
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Ab initio study of the electronic structures and conduction properties of some novel low band-gap donor–acceptor polymers
Solid State Communications
◽
10.1016/j.ssc.2003.10.013
◽
2004
◽
Vol 129
(5)
◽
pp. 335-340
◽
Cited By ~ 6
Author(s):
A.K. Bakhshi
◽
Geetika Gandhi
Keyword(s):
Ab Initio
◽
Band Gap
◽
Electronic Structures
◽
Ab Initio Study
◽
Low Band Gap
◽
Donor Acceptor
◽
Conduction Properties
Download Full-text
Band-gap sensitive adsorption of fluorine molecules on sidewalls of carbon nanotubes: an ab initio study
Nanotechnology
◽
10.1088/0957-4484/17/23/025
◽
2006
◽
Vol 17
(23)
◽
pp. 5862-5865
◽
Cited By ~ 7
Author(s):
Woon Ih Choi
◽
Sohee Park
◽
Tae-Eun Kim
◽
Noejung Park
◽
Kwang-Ryeol Lee
◽
...
Keyword(s):
Carbon Nanotubes
◽
Ab Initio
◽
Band Gap
◽
Ab Initio Study
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Giant Magnetic Band Gap in the Rashba-Split Surface State of Vanadium-Doped BiTeI: A Combined Photoemission and Ab Initio Study
Scientific Reports
◽
10.1038/s41598-017-03507-0
◽
2017
◽
Vol 7
(1)
◽
Cited By ~ 6
Author(s):
I. I. Klimovskikh
◽
A. M. Shikin
◽
M. M. Otrokov
◽
A. Ernst
◽
I. P. Rusinov
◽
...
Keyword(s):
Ab Initio
◽
Band Gap
◽
Surface State
◽
Ab Initio Study
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Band gap, electronic and optical properties of Zn1−xCrxS: An ab initio study
Journal of Alloys and Compounds
◽
10.1016/j.jallcom.2012.11.201
◽
2013
◽
Vol 555
◽
pp. 117-122
◽
Cited By ~ 27
Author(s):
Yuhong Huang
◽
Wanqi Jie
◽
Gangqiang Zha
Keyword(s):
Optical Properties
◽
Ab Initio
◽
Band Gap
◽
Ab Initio Study
◽
Electronic And Optical Properties
Download Full-text
Ab initio study of novel low-band-gap donor–acceptor polymers based on poly(cyclopentadienylene)
Journal of the Chemical Society Faraday Transactions
◽
10.1039/a803155j
◽
1998
◽
Vol 94
(18)
◽
pp. 2823-2826
◽
Cited By ~ 8
Author(s):
A. K. Bakhshi
◽
Pooja Rattan
Keyword(s):
Ab Initio
◽
Band Gap
◽
Ab Initio Study
◽
Low Band Gap
◽
Donor Acceptor
Download Full-text
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