Difference between revisions of "To-Do List"
From William Parker Wiki
(Created page with "==Active== ===Silicon Nanomembrane Transition Project=== ====Figures To Make==== * KS bands/DOS (all layers; diamond & β-tin; PBE & SCAN) * ln(a) vs ln(c) [Poisson rati...") |
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* Reduced volume vs pressure (all layers; diamond & β-tin; PBE & SCAN) | * Reduced volume vs pressure (all layers; diamond & β-tin; PBE & SCAN) | ||
* Enthalpy vs volume (all layers; diamond & β-tin; PBE & SCAN) | * Enthalpy vs volume (all layers; diamond & β-tin; PBE & SCAN) | ||
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| + | ====Structures To Optimize==== | ||
| + | * 1-ML diamond (PBE) | ||
Revision as of 16:08, 26 July 2021
Contents
Active
Silicon Nanomembrane Transition Project
Figures To Make
- KS bands/DOS (all layers; diamond & β-tin; PBE & SCAN)
- ln(a) vs ln(c) [Poisson ratio] (all layers; diamond & β-tin; PBE & SCAN)
- Reduced volume vs pressure (all layers; diamond & β-tin; PBE & SCAN)
- Enthalpy vs volume (all layers; diamond & β-tin; PBE & SCAN)
Structures To Optimize
- 1-ML diamond (PBE)
