Structural, Electronic, and Optical Properties of Ag-Doped ZnO Nanowires: First Principles Study

The Journal of Physical Chemistry C ◽

10.1021/jp1098816 ◽

2011 ◽

Vol 115 (9) ◽

pp. 3552-3557 ◽

Author(s):

Yanlu Li ◽

Xian Zhao ◽

Weiliu Fan

Keyword(s):

Optical Properties ◽

First Principles ◽

Zno Nanowires ◽

Electronic And Optical Properties ◽

First Principles Study ◽

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First principles study on the electronic and optical properties of Al- and Si-doped ZnO with GGA and mBJ approximations

Optical and Quantum Electronics ◽

10.1007/s11082-014-0052-7 ◽

2014 ◽

Vol 47 (7) ◽

pp. 1869-1880 ◽

Author(s):

A. Abbassi ◽

H. Ez-Zahraouy ◽

A. Benyoussef

Keyword(s):

Optical Properties ◽

First Principles ◽

Electronic And Optical Properties ◽

First Principles Study ◽

Si Doped ◽

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First-principles study of the electronic and optical properties of ZnO nanowires

Chinese Physics B ◽

10.1088/1674-1056/18/6/065 ◽

2009 ◽

Vol 18 (6) ◽

pp. 2508-2513 ◽

Author(s):

Zhang Fu-Chun ◽

Zhang Zhi-Yong ◽

Zhang Wei-Hu ◽

Yan Jun-Feng ◽

Yong Jiang-Ni

Keyword(s):

Optical Properties ◽

First Principles ◽

Zno Nanowires ◽

Electronic And Optical Properties ◽

First Principles Study

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First principles study of the structural, electronic, and optical properties of Sn2+-doped ZnO–P2O5 glasses

Journal of Non-Crystalline Solids ◽

10.1016/j.jnoncrysol.2018.04.016 ◽

2018 ◽

Vol 492 ◽

pp. 108-114 ◽

Author(s):

Kyoung E. Kweon ◽

Vincenzo Lordi

Keyword(s):

Optical Properties ◽

First Principles ◽

Electronic And Optical Properties ◽

First Principles Study ◽

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First-principles study on electronic and optical properties of S, N single-doped and S-N co-doped ZnO

Physics Letters A ◽

10.1016/j.physleta.2019.126172 ◽

2020 ◽

Vol 384 (8) ◽

pp. 126172 ◽

Author(s):

Wei-wei Liu ◽

Cheng-lin Liu ◽

Xiao-bo Chen ◽

Jian-hua Lu ◽

Hong-xia Chen ◽

...

Keyword(s):

Optical Properties ◽

First Principles ◽

Electronic And Optical Properties ◽

First Principles Study ◽

Doped Zno ◽

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The structural, electronic and optical properties of in-doped ZnO monolayer: A first principles study

10.1063/5.0046130 ◽

2021 ◽

Author(s):

Sandhya Y. Wakhare ◽

Mrinalini D. Deshpande

Keyword(s):

Optical Properties ◽

First Principles ◽

Electronic And Optical Properties ◽

First Principles Study ◽

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Adjustable electronic and optical properties of BlueP/MoS2 van der Waals heterostructure by external strain: a first-principles study

Nanotechnology ◽

10.1088/1361-6528/ab978b ◽

2020 ◽

Vol 31 (37) ◽

pp. 375706 ◽

Author(s):

Fei Yang ◽

Junnan Han ◽

Le Zhang ◽

Xianhong Tang ◽

Zhenguo Zhuo ◽

...

Keyword(s):

Optical Properties ◽

First Principles ◽

Van Der Waals ◽

Electronic And Optical Properties ◽

First Principles Study ◽

Van Der Waals Heterostructure ◽

External Strain

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First-principles study on structural, electronic and optical properties of perovskite solid solutions KB1−xMgxI3 (B = Ge, Sn) toward water splitting photocatalysis

RSC Advances ◽

10.1039/d1ra04534b ◽

2021 ◽

Vol 11 (42) ◽

pp. 26432-26443

Author(s):

Chol-Hyok Ri ◽

Yun-Sim Kim ◽

Un-Gi Jong ◽

Yun-Hyok Kye ◽

Se-Hun Ryang ◽

...

Keyword(s):

Optical Properties ◽

Water Splitting ◽

Potassium Iodide ◽

Solid Solutions ◽

First Principles ◽

Lead Free ◽

First Principles Calculations ◽

Electronic And Optical Properties ◽

First Principles Study

We propose lead-free potassium iodide perovskite solid solutions KBI3 with B-site mixing between Ge/Sn and Mg as potential candidates for photocatalysts based on systematic first-principles calculations.

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Electronic and Optical Properties of PTCDI Adsorbed Graphene Heterostructure: A First Principles Study

Journal of Physics and Chemistry of Solids ◽

10.1016/j.jpcs.2021.110109 ◽

2021 ◽

pp. 110109

Author(s):

Sumona Sinha ◽

Supriya Ghosal ◽

Debnarayan Jana

Keyword(s):

Optical Properties ◽

First Principles ◽

Electronic And Optical Properties ◽

First Principles Study

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First-principles study on electronic and optical properties of Cu2ZnSiV I4 (VI=S, Se, and Te) quaternary semiconductors

AIP Advances ◽

10.1063/1.4920936 ◽

2015 ◽

Vol 5 (5) ◽

pp. 057111 ◽

Author(s):

Xuebiao Zhang ◽

Dewei Rao ◽

Ruifeng Lu ◽

Kaiming Deng ◽

Dongguo Chen

Keyword(s):

Optical Properties ◽

First Principles ◽

Electronic And Optical Properties ◽

First Principles Study

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First-principles study of the stability, mechanical, electronic and optical properties of Cd0.75Hg0.25Se

Chemical Physics ◽

10.1016/j.chemphys.2021.111164 ◽

2021 ◽

pp. 111164

Author(s):

Diwen Liu ◽

Xueyou Wang ◽

Yanjie Zhang ◽

Rongjian Sa

Keyword(s):

Optical Properties ◽

First Principles ◽

Electronic And Optical Properties ◽

First Principles Study ◽

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