Phase diagram and electrochemical properties of mixed olivines from first-principles calculations
Using first-principles calculations, we study the effect of cation substitution on the transition-metal sublattice in phospho-olivines, with special attention given to the Li[subscript x](Fe[subscript 1−y]Mn[subscript y])PO[subscript 4] system. We use a cluster expansion model derived from first-pri...
| Main Authors: | , , |
|---|---|
| Other Authors: | |
| Format: | Article |
| Language: | English |
| Published: |
American Physical Society,
2010-02-12T14:08:31Z.
|
| Subjects: | |
| Online Access: | Get fulltext |