1. Investigation on Organic Molecule Additive for Moisture Stability and Defect Passivation via Physisorption in CH3NH3PbI3 Based Perovskite
- Author
-
Amrita Dey, Parag Bhargava, Shivam Singh, K. L. Narasimhan, Bosky Sharma, Gangadhar Banappanavar, Dinesh Kabra, and Sudip Chakraborty
- Subjects
Solid-state chemistry ,Materials science ,Passivation ,Open-circuit voltage ,business.industry ,Energy Engineering and Power Technology ,02 engineering and technology ,Electroluminescence ,010402 general chemistry ,021001 nanoscience & nanotechnology ,01 natural sciences ,0104 chemical sciences ,Contact angle ,Semiconductor ,Chemical engineering ,Physisorption ,Materials Chemistry ,Electrochemistry ,Chemical Engineering (miscellaneous) ,Electrical and Electronic Engineering ,0210 nano-technology ,business ,Perovskite (structure) - Abstract
We investigate the role of n-type organic molecule, bathocuproine (BCP), additive in perovskite semiconductor film based solar cells using first principle calculations and optoelectronic studies. A state-of-art high fill factor of 0.82 and improved open circuit voltage of 0.95 V for CH3NH3PbI3 (MAPI) based perovskite solar cells are achieved in addition with highly improved (more than one order) electroluminescence efficiency. Delayed emission spectroscopy does not show any blue shift peak or double peak emission suggests no structural changes in 3D perovskite. Contact angle studies using water droplet supports BCP is forming a capping layer to boost moisture barrier. Our experimental findings regarding no 2D structure formation has also been supported by first-principles electronic structure calculations based on DFT in MAPI after insertion of BCP. Furthermore, calculations suggest that a physisorption type of interaction has been found in between MAPI and BCP with an average distance of 2.9 A. These res...
- Published
- 2018
- Full Text
- View/download PDF