The effect of vacancy defects on the electromechanical properties of monolayer NiTe2 from first principles calculations
The electromechanical properties of monolayer 1-T NiTe2 under charge actuation were investigated using first-principles density functional theory (DFT) calculations. Monolayer 1-T NiTe2 in its pristine form has a work area density per cycle of up to 5.38 MJ m−3 nm upon charge injection and it can ge...
| Published in: | Physical Chemistry Chemical Physics |
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| Main Author: | |
| Format: | Article |
| Language: | English |
| Published: |
Royal Society of Chemistry
2022
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| Online Access: | https://www.scopus.com/inward/record.uri?eid=2-s2.0-85143981726&doi=10.1039%2fd2cp05102h&partnerID=40&md5=a43f83f9776180d29b0b5e84ec582509 |