Study on the structures and electronic properties of double-walled silicon nanotubes (4,min)@(8,mout) under external electric field by SCC-DFTB calculations

2022 ◽  
Vol 202 ◽  
pp. 110984
Author(s):  
Lijun Wu ◽  
Yan Han ◽  
Shangfeng Chen ◽  
Wu Li ◽  
Longhai Shen
2015 ◽  
Vol 115 (1) ◽  
Author(s):  
Changwon Park ◽  
Junga Ryou ◽  
Suklyun Hong ◽  
Bobby G. Sumpter ◽  
Gunn Kim ◽  
...  

2018 ◽  
Vol 20 (16) ◽  
pp. 11369-11377 ◽  
Author(s):  
Yingcai Fan ◽  
Xiaobiao Liu ◽  
Junru Wang ◽  
Haoqiang Ai ◽  
Mingwen Zhao

The tunable electronic properties of Si/InSe and Ge/InSe HLs by applying an external electric field or strain.


2020 ◽  
Vol 44 (34) ◽  
pp. 14513-14528
Author(s):  
Alireza Soltani ◽  
Mohammad Ramezanitaghartapeh ◽  
Masoud Bezi Javan ◽  
Mohammad T. Baei ◽  
Andrew Ng Kay Lup ◽  
...  

The interaction energies and optoelectronic properties of sarin (SF) and chlorosarin (SC) on the B12N12 with and without the presence of an electric field have been studied using density functional theory (DFT) calculations.


2019 ◽  
Vol 21 (15) ◽  
pp. 7765-7772 ◽  
Author(s):  
Yuting Wei ◽  
Fei Wang ◽  
Wenli Zhang ◽  
Xiuwen Zhang

The 0.52/0.83 eV direct bandgap of P/PbI2 possesses a type-II band alignment, can effectively be regulated to 0.90/1.54 eV using an external electric field in DFT/HSE06, and is useful for solar energy and optoelectronic devices.


RSC Advances ◽  
2017 ◽  
Vol 7 (41) ◽  
pp. 25582-25588 ◽  
Author(s):  
Yaqiang Ma ◽  
Xu Zhao ◽  
Mengmeng Niu ◽  
Xianqi Dai ◽  
Wei Li ◽  
...  

The future development of optoelectronic devices will require an advanced control technology in electronic properties, for example by an external electric field (Efield).


This paper reviews recent calculations on the effect of an external electric field on surface electronic properties, in particular using the embedding method for solving the Schrödinger equation at the surface. The shape of the screening charge and its field dependence are discussed, and the results are compared with experiments in which the image plane is determined. The force on the surface atoms in the field is given in terms of an effective charge, which also determines the work-function variation with surface displacements. This relationship can lead to a surface instability if the effective charge is big enough.


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