First-Principles DFT Calculations for Perovskite Solar Cells

2018 ◽  
pp. 487-509 ◽  
Author(s):  
Jing Shi ◽  
Sining Yun
Keyword(s):  
Solar Cells ◽  
Dft Calculations ◽  
First Principles ◽  
Perovskite Solar Cells

Halide perovskite materials for solar cells: a theoretical review

2015 ◽  
Vol 3 (17) ◽  
pp. 8926-8942 ◽  
Author(s):  
Wan-Jian Yin ◽  
Ji-Hui Yang ◽  
Joongoo Kang ◽  
Yanfa Yan ◽  
Su-Huai Wei
Keyword(s):  
Solar Cells ◽  
First Principles ◽  
Perovskite Solar Cells ◽  
First Principles Calculations ◽  
Perovskite Materials ◽  
Halide Perovskite

First-principles calculations help to understand the fundamental mechanisms of the emerging perovskite solar cells and guide further developments.

First-principles study on CH3NH3PbI3 materials for perovskite solar cells

2018 ◽  
Vol 550 ◽  
pp. 347-353
Author(s):  
Shengzhao Wang ◽  
Jianliang Qiao ◽  
Yuan Xu ◽  
Xinfeng Guo ◽  
Chunjuan Nan
Keyword(s):  
Solar Cells ◽  
First Principles ◽  
Perovskite Solar Cells ◽  
First Principles Study

First-Principles Calculations for the Interfaces of Perovskite Solar Cells

2021 ◽  
pp. 95-158
Author(s):  
Jun-Peng An ◽  
Ying Tian ◽  
Hong-Tao Xue ◽  
Jun-Chen Li ◽  
Jun-Qiang Ren ◽  
...  
Keyword(s):  
Solar Cells ◽  
First Principles ◽  
Perovskite Solar Cells ◽  
First Principles Calculations

A first-principles study on the chemical stability of inorganic perovskite solid solutions Cs1−xRbxPbI3 at finite temperature and pressure

2018 ◽  
Vol 6 (37) ◽  
pp. 17994-18002 ◽  
Author(s):  
Un-Gi Jong ◽  
Chol-Jun Yu ◽  
Yun-Hyok Kye ◽  
Yun-Sim Kim ◽  
Chol-Ho Kim ◽  
...  
Keyword(s):  
Solar Cells ◽  
Solid Solutions ◽  
Chemical Stability ◽  
First Principles ◽  
Finite Temperature ◽  
Perovskite Solar Cells ◽  
Significant Research ◽  
Absorbing Material ◽  
Halide Perovskite ◽  
Temperature And Pressure

The inorganic halide perovskite Cs(Rb)PbI3 has attracted significant research interest for its application as a light-absorbing material in perovskite solar cells (PSCs).

scholarly journals Photo-energy Conversion Efficiency of CH3NH3PbI3/C60 Heterojunction Perovskite Solar Cells from First-principles

2021 ◽  
Author(s):  
Khian-Hooi Chew ◽  
Riichi Kuwahara ◽  
Kaoru Ohno
Keyword(s):  
Solar Cells ◽  
Energy Conversion ◽  
Conversion Efficiency ◽  
First Principles ◽  
Perovskite Solar Cells ◽  
Energy Conversion Efficiency ◽  
Potential Candidate ◽  
Next Generation ◽  
First Principles Study ◽  
Halide Perovskites

Halide perovskites have emerged as the most potential candidate for the next-generation solar cells. In this work, we conduct a comprehensive first-principles study on the photo-energy conversion efficiency (PCE) of...

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