scholarly journals First-principles study of electronic structures and optical properties of Cu, Ag, and Au-doped anatase TiO2

2012 ◽  
Vol 407 (6) ◽  
pp. 1003-1007 ◽  
Author(s):  
Meili Guo ◽  
Jiulin Du
Keyword(s):  
Optical Properties ◽  
First Principles ◽  
Electronic Structures ◽  
Anatase Tio2 ◽  
First Principles Study

Electronic and optical properties of hydrogen-terminated biphenylene nanoribbon：a first-principles study

2021 ◽  
Author(s):  
Hong Shen ◽  
Riyi Yang ◽  
Kun Xie ◽  
Zhiyuan Yu ◽  
Yuxiang Zheng ◽  
...  
Keyword(s):  
Optical Properties ◽  
First Principles ◽  
Electronic Structures ◽  
First Principles Calculation ◽  
Electronic And Optical Properties ◽  
First Principles Study

The electronic structures and optical properties of novel 2D biphenylene and hydrogen-terminated nanoribbons of different widths which are cut from a layer of biphenylene were explored by first-principles calculation. The...

scholarly journals Insights into the Impact of Yttrium Doping at the Ba and Ti Sites of BaTiO3 on the Electronic Structures and Optical Properties: A First-Principles Study

ACS Omega ◽  
2020 ◽  
Vol 5 (25) ◽  
pp. 15502-15509
Author(s):  
Adil Alshoaibi ◽  
Mohammed Benali Kanoun ◽  
Bakhtiar Ul Haq ◽  
Salem AlFaify ◽  
Souraya Goumri-Said
Keyword(s):  
Optical Properties ◽  
First Principles ◽  
Electronic Structures ◽  
First Principles Study ◽  
The Impact ◽  
Yttrium Doping

First-principles study on the electronic structures and optical properties of ZnV2O6

Optik ◽  
2020 ◽  
Vol 207 ◽  
pp. 163789
Author(s):  
Anqi Yang ◽  
Jiaolian Luo ◽  
Xuan Cao ◽  
Zhenyu Xie
Keyword(s):  
Optical Properties ◽  
First Principles ◽  
Electronic Structures ◽  
First Principles Study

First-principles study of Ce-doped Y3Al5O12 with Si–N incorporation: electronic structures and optical properties

2016 ◽  
Vol 4 (23) ◽  
pp. 5214-5221 ◽  
Author(s):  
Lixin Ning ◽  
Xiaowen Ji ◽  
Yuanyuan Dong ◽  
Wei Jin ◽  
Yucheng Huang ◽  
...  
Keyword(s):  
Optical Properties ◽  
First Principles ◽  
Electronic Structures ◽  
First Principles Calculations ◽  
First Principles Study ◽  
N Incorporation

Effects of Si–N incorporation on electronic structures and optical properties of YAG:Ce were investigated by first-principles calculations.

The effect of Ta dopant on the electronic and optical properties of anatase TiO2: a first-principles study

2017 ◽  
Vol 4 (2) ◽  
pp. 024002 ◽  
Author(s):  
Shibghatullah Muhammady ◽  
Eka Nurfani ◽  
Robi Kurniawan ◽  
Inge Magdalena Sutjahja ◽  
Toto Winata ◽  
...  
Keyword(s):  
Optical Properties ◽  
First Principles ◽  
Anatase Tio2 ◽  
Electronic And Optical Properties ◽  
First Principles Study

scholarly journals First-principles study on the electronic structures and absorption spectra of Sm-N codoped anatase TiO2

2012 ◽  
Vol 61 (16) ◽  
pp. 167103
Author(s):  
Li Cong ◽  
Hou Qing-Yu ◽  
Zhang Zhen-Duo ◽  
Zhao Chun-Wang ◽  
Zhang Bing
Keyword(s):  
Absorption Spectra ◽  
First Principles ◽  
Electronic Structures ◽  
Anatase Tio2 ◽  
First Principles Study

First-principles study on the electronic structures and optical properties of RbVO3

2020 ◽  
Vol 218 ◽  
pp. 116832 ◽  
Author(s):  
Jiaolian Luo ◽  
Xiaohui Wang ◽  
Anqi Yang ◽  
Yunfei Zhu
Keyword(s):  
Optical Properties ◽  
First Principles ◽  
Electronic Structures ◽  
First Principles Study
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