Evaluation of Olivine LiFePO4 Polyanionic Cathode Material Using Density Functional Theory
The first principles study on the LiFePO4 and FePO4 crystal has been evaluated using the density functional theory encrypted in the Cambridge Serial Total Energy Package (CASTEP) computer code. The structural properties, electronic properties, and intercalation voltage of the cathode material are pr...
| Published in: | Key Engineering Materials |
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| Main Author: | |
| Format: | Conference paper |
| Language: | English |
| Published: |
Trans Tech Publications Ltd
2022
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| Online Access: | https://www.scopus.com/inward/record.uri?eid=2-s2.0-85127272094&doi=10.4028%2fp-csw2yc&partnerID=40&md5=03be04989e334ad14bbd43454244d252 |