ChemInform Abstract: (Cu2S2)(Sr3Se2O5) — A Layered, Direct Band Gap, p-Type Transparent Conducting Oxychalcogenide: A Theoretical Analysis.

ChemInform ◽  
2010 ◽  
Vol 41 (5) ◽  
Author(s):  
David O. Scanlon ◽  
Graeme W. Watson
2015 ◽  
Vol 644 ◽  
pp. 16-21 ◽  
Author(s):  
Koichi Nakamura

The piezoresistivity for force sensing in wurtzite-ZnO nanowires with [0001] orientation has been simulated on the basis of the first-principles calculations of model structures. According to the difference in wall structure, our devised nanowire models can be divided into three groups by their conductivities; no band-gap conducting models, direct band-gap semiconducting models, and indirect band-gap semiconducting models. The strain responses to carrier conductivity of n-or p-doped semiconducting wurtzite-ZnO[0001] nanowire models were calculated using band carrier densities and their corresponding effective masses derived from the one-dimensional band diagram by our original procedure for a small amount of carrier occupation. The conductivities of p-type direct band-gap models change drastically due to longitudinal uniaxial strain in the simulation: the longitudinal piezoresistance coefficient is 120 × 10–11 Pa–1 for p-type (ZnO)24 nanowire model with 1% compressive strain at room temperature.


2017 ◽  
Vol 5 (21) ◽  
pp. 5076-5082 ◽  
Author(s):  
Yangyang Ren ◽  
Junyou Yang ◽  
Qinghui Jiang ◽  
Dan Zhang ◽  
Zhiwei Zhou ◽  
...  

Pristine MnTe is a p-type semiconductor with a relatively low hole concentration of 1018 cm−3, low electrical conductivity, and thus poor TE performance at room temperature owing to the broad direct band gap of 1.27 eV.


2018 ◽  
Vol 54 (99) ◽  
pp. 13949-13952 ◽  
Author(s):  
Y. Wang ◽  
H. X. Ge ◽  
Y. P. Chen ◽  
X. Y. Meng ◽  
J. Ghanbaja ◽  
...  

Wurtzite CoO is a p-type semiconductor with a direct band gap of 1.6 eV and an intense sub-gap absorption.


Nanoscale ◽  
2019 ◽  
Vol 11 (42) ◽  
pp. 20123-20132 ◽  
Author(s):  
Mohammad Rezwan Habib ◽  
Shengping Wang ◽  
Weijia Wang ◽  
Han Xiao ◽  
Sk Md Obaidulla ◽  
...  

2D layered CrS2 flakes down to the monolayer are successfully synthesized, and different phases of CrS2 are observed and exhibit direct band gap p-type semiconducting, metallic, and semi-metallic behaviors, respectively.


Electronics ◽  
2021 ◽  
Vol 10 (9) ◽  
pp. 988
Author(s):  
Chrysa Aivalioti ◽  
Alexandros Papadakis ◽  
Emmanouil Manidakis ◽  
Maria Kayambaki ◽  
Maria Androulidaki ◽  
...  

Nickel oxide (NiO) is a p-type oxide and nitrogen is one of the dopants used for modifying its properties. Until now, nitrogen-doped NiO has shown inferior optical and electrical properties than those of pure NiO. In this work, we present nitrogen-doped NiO (NiO:N) thin films with enhanced properties compared to those of the undoped NiO thin film. The NiO:N films were grown at room temperature by sputtering using a plasma containing 50% Ar and 50% (O2 + N2) gases. The undoped NiO film was oxygen-rich, single-phase cubic NiO, having a transmittance of less than 20%. Upon doping with nitrogen, the films became more transparent (around 65%), had a wide direct band gap (up to 3.67 eV) and showed clear evidence of indirect band gap, 2.50–2.72 eV, depending on %(O2-N2) in plasma. The changes in the properties of the films such as structural disorder, energy band gap, Urbach states and resistivity were correlated with the incorporation of nitrogen in their structure. The optimum NiO:N film was used to form a diode with spin-coated, mesoporous on top of a compact, TiO2 film. The hybrid NiO:N/TiO2 heterojunction was transparent showing good output characteristics, as deduced using both I-V and Cheung’s methods, which were further improved upon thermal treatment. Transparent NiO:N films can be realized for all-oxide flexible optoelectronic devices.


2013 ◽  
Vol 652-654 ◽  
pp. 527-531 ◽  
Author(s):  
A.N. Alias ◽  
T.I. Tunku Kudin ◽  
Z.M. Zabidi ◽  
M.K. Harun ◽  
Ab Malik Marwan Ali ◽  
...  

The optical absorption spectra of blended poly (N-carbazole) (PVK) with polyvinylpyrrolidone (PVP) in various compositions are investigated. A doctor blade technique was used to coat the blended polymer on a quartz substrate. The electronic parameters such as absorption edge (Ee), allowed direct band gap (Ed), allowed indirect band gap (Ei), Urbach edge (Eu) and steepness parameter (γ) were calculated using Tauc/Davis-Mott Model. The results reveal that the Ee, Ed and Ei increase with increasing of PVP ratio. There also have variation changing in Urbach energy and steepness parameter.


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