Electronic Properties of a New All-Inorganic Perovskite TlPbI3 Simulated by the First Principles

Electronic Properties of a New All-Inorganic Perovskite TlPbI3 Simulated by the First Principles

Abstract All-inorganic perovskites have been recognized as promising photovoltaic materials. We simulated the perovskite material of TlPbI3 using ab initio electronic structure calculations. The band gap of 1.33 eV is extremely close to the theoretical optimum value. Compared TlPbI3 with CsPbI3, the...

Full description

Bibliographic Details
Main Authors: Zhao Liu, Ting Zhang, Yafei Wang, Chenyun Wang, Peng Zhang, Hojjatollah Sarvari, Zhi Chen, Shibin Li
Format: Article
Language:English
Published: SpringerOpen 2017-03-01
Series:Nanoscale Research Letters
Subjects:
All-inorganic perovskite
TlPbI3
CsPbI3
First principles
Online Access:http://link.springer.com/article/10.1186/s11671-017-2015-y

Similar Items

Similar Items