Difference between revisions of "Iridium"
From William Parker Wiki
(Added planewave energy cutoff section and figure link) |
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==Next step== | ==Next step== | ||
* Test k-point convergence | * Test k-point convergence | ||
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| + | ==Comparison== | ||
| + | * [https://sites.google.com/site/eampotentials/Ir#TOC-Phonon-Dispersion-Curves EAM Potentials] | ||
Latest revision as of 15:46, 5 April 2023
Contents
Crystal structures
- Fm3̅m [1]
Pseudopotentials
- PBEsol SSSP efficiency [2]
Convergence Tests
Planewave Energy Cutoff
Next step
- Test k-point convergence
