First-principles investigation of structural modification, fine band gap engineering, and optical response of La1−xBaxGaO3 for optoelectronic applications

2020 ◽  
Vol 126 (9) ◽  
Author(s):  
Muhammad Rizwan ◽  
A. Khadija ◽  
I. Zeba ◽  
M. Shakil ◽  
Zahid Usman ◽  
...  
Keyword(s):  
Band Gap ◽  
First Principles ◽  
Structural Modification ◽  
Optical Response ◽  
Band Gap Engineering ◽  
Optoelectronic Applications

scholarly journals Band-gap tuning and optical response of two-dimensionalSixC1−x: A first-principles real-space study of disordered two-dimensional materials

2017 ◽  
Vol 96 (5) ◽  
Author(s):  
Banasree Sadhukhan ◽  
Prashant Singh ◽  
Arabinda Nayak ◽  
Sujoy Datta ◽  
Duane D. Johnson ◽  
...  
Keyword(s):  
Band Gap ◽  
First Principles ◽  
Optical Response ◽  
Real Space ◽  
Two Dimensional ◽  
Two Dimensional Materials ◽  
Band Gap Tuning

Band gap engineering of FeS2 under biaxial strain: a first principles study

2014 ◽  
Vol 16 (44) ◽  
pp. 24466-24472 ◽  
Author(s):  
Pin Xiao ◽  
Xiao-Li Fan ◽  
Li-Min Liu ◽  
Woon-Ming Lau
Keyword(s):  
Band Gap ◽  
First Principles ◽  
Tensile Strain ◽  
Biaxial Strain ◽  
Band Gap Engineering ◽  
First Principles Study ◽  
Maximum Value

The band gap increases with increasing tensile strain to its maximum value at 6% strain and then decreases.

scholarly journals Bandgap engineering of few-layered MoS2 with low concentrations of S vacancies

RSC Advances ◽  
2020 ◽  
Vol 10 (27) ◽  
pp. 15702-15706 ◽  
Author(s):  
Wen He ◽  
Jia Shi ◽  
Hongkang Zhao ◽  
Hui Wang ◽  
Xinfeng Liu ◽  
...  
Keyword(s):  
Band Gap ◽  
Molybdenum Disulfide ◽  
Bandgap Engineering ◽  
Band Gap Engineering ◽  
Low Concentrations ◽  
Optoelectronic Applications ◽  
Layered Mos2

Band-gap engineering of molybdenum disulfide (MoS2) by introducing vacancies is of particular interest owing to the potential optoelectronic applications.

Role of 4p-3d orbital hybridization on band gap engineering of heavy metal glass for optoelectronic applications

2014 ◽  
Vol 605 ◽  
pp. 157-163 ◽  
Author(s):  
Fouad El-Diasty ◽  
F.A. Moustafa ◽  
F.A. Abdel-Wahab ◽  
M. Abdel-Baki ◽  
A.M. Fayad
Keyword(s):  
Heavy Metal ◽  
Band Gap ◽  
Band Gap Engineering ◽  
Orbital Hybridization ◽  
Optoelectronic Applications

Contrastive band gap engineering of strained graphyne nanoribbons with armchair and zigzag edges

RSC Advances ◽  
2015 ◽  
Vol 5 (73) ◽  
pp. 59344-59348 ◽  
Author(s):  
Xin Cong ◽  
Yiming Liao ◽  
Qiji Peng ◽  
Yidan Yang ◽  
Chuan Cheng ◽  
...  
Keyword(s):  
Band Gap ◽  
First Principles ◽  
First Principles Calculations ◽  
Band Structures ◽  
Band Gap Engineering

By using first-principles calculations, the band structures of graphyne nanoribbons with armchair (a-GNRs) and zigzag (z-GNRs) edges under various strains are investigated.

Band gap engineering of monolayer ZrGeTe4 via strain: A first-principles study

2020 ◽  
Vol 253 ◽  
pp. 123308 ◽  
Author(s):  
Mukhtar Lawan Adam ◽  
Oyawale Adetunji Moses ◽  
Zia ur Rehman ◽  
Zhanfeng Liu ◽  
Li Song ◽  
...  
Keyword(s):  
Band Gap ◽  
First Principles ◽  
Band Gap Engineering ◽  
First Principles Study
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