scholarly journals Experimental and Theoretical Study into Interface Structure and Band Alignment of the Cu2Zn1–xCdxSnS4 Heterointerface for Photovoltaic Applications

2020 ◽  
Vol 3 (6) ◽  
pp. 5153-5162
Author(s):  
Sachin R. Rondiya ◽  
Yogesh Jadhav ◽  
Nelson Y. Dzade ◽  
Raihan Ahammed ◽  
Tanmay Goswami ◽  
...  
Keyword(s):  
Theoretical Study ◽  
Interface Structure ◽  
Band Alignment ◽  
Photovoltaic Applications

CZTS/CdS: interface properties and band alignment study towards photovoltaic applications

2017 ◽  
Vol 29 (5) ◽  
pp. 4201-4210 ◽  
Author(s):  
Sachin Rondiya ◽  
Avinash Rokade ◽  
Priyanka Sharma ◽  
Minakshi Chaudhary ◽  
Adinath Funde ◽  
...  
Keyword(s):  
Band Alignment ◽  
Interface Properties ◽  
Photovoltaic Applications

Band alignment and charge transfer predictions of ZnO/ZnX (X = S, Se or Te) interfaces applied to solar cells: a PBE+U theoretical study

2018 ◽  
Vol 20 (7) ◽  
pp. 4953-4961 ◽  
Author(s):  
Efracio Mamani Flores ◽  
Rogério Almeida Gouvea ◽  
Maurício Jeomar Piotrowski ◽  
Mário Lucio Moreira
Keyword(s):  
Solar Cells ◽  
Charge Transfer ◽  
First Principles ◽  
Theoretical Study ◽  
Band Alignment ◽  
First Principles Calculations

We performed first-principles calculations within PBE and PBE+U approximations to study ZnO and ZnX bulk systems and ZnO/ZnX interfaces (X = S, Se or Te), to the better comprehension of charge transference through the interface.

scholarly journals Indirect-to-direct band gap transition and optical properties of metal alloys of Cs2Te1−xTixI6: a theoretical study

RSC Advances ◽  
2020 ◽  
Vol 10 (60) ◽  
pp. 36734-36740
Author(s):  
Diwen Liu ◽  
Wenying Zha ◽  
Rusheng Yuan ◽  
Benyong Lou ◽  
Rongjian Sa
Keyword(s):  
Optical Properties ◽  
Band Gap ◽  
Theoretical Study ◽  
Metal Alloys ◽  
Double Perovskites ◽  
Direct Band Gap ◽  
Photovoltaic Applications ◽  
Direct Band

In recent years, double perovskites have attracted considerable attention as potential candidates for photovoltaic applications.

scholarly journals Mixed-Cation Mixed-Metal Halide Perovskites for Photovoltaic Applications: A Theoretical Study

ACS Omega ◽  
2020 ◽  
Vol 5 (8) ◽  
pp. 4347-4351 ◽  
Author(s):  
Rongjian Sa ◽  
Diwen Liu ◽  
Yiting Chen ◽  
Shaoming Ying
Keyword(s):  
Theoretical Study ◽  
Metal Halide ◽  
Mixed Metal ◽  
Mixed Cation ◽  
Photovoltaic Applications ◽  
Halide Perovskites

The interface structure and band alignment at alumina/Cu(Al) alloy interfaces—Influence of the crystallinity of alumina films

2010 ◽  
Vol 256 (10) ◽  
pp. 3051-3057 ◽  
Author(s):  
Michiko Yoshitake ◽  
Weijie Song ◽  
Jiří Libra ◽  
Karel Mašek ◽  
František Šutara ◽  
...  
Keyword(s):  
Interface Structure ◽  
Band Alignment ◽  
Al Alloy ◽  
Alumina Films

Optoelectronic properties of oligomers based on tetrazine, benzothiadiazole, benzodithiophene and thiophene moieties for photovoltaic applications: a theoretical study

RSC Advances ◽  
2015 ◽  
Vol 5 (102) ◽  
pp. 83960-83968 ◽  
Author(s):  
Massimo Ottonelli ◽  
Marina Alloisio ◽  
Ivana Moggio ◽  
M. Isabel Martinez Espinosa ◽  
Eduardo Arias
Keyword(s):  
Theoretical Study ◽  
Optoelectronic Properties ◽  
Design Approach ◽  
Organic Photovoltaic ◽  
Photovoltaic Devices ◽  
Organic Photovoltaic Devices ◽  
Theoretical Design ◽  
Photovoltaic Applications

In this article, a fast theoretical design approach for addressing the synthesis of new conjugated co-polymers for applications in organic photovoltaic devices is discussed.

Theoretical study of the insulator/insulator interface: Band alignment at theSiO2∕HfO2junction

2007 ◽  
Vol 75 (3) ◽  
Author(s):  
Onise Sharia ◽  
Alexander A. Demkov ◽  
Gennadi Bersuker ◽  
Byoung Hun Lee
Keyword(s):  
Theoretical Study ◽  
Band Alignment ◽  
Insulator Interface
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