Top network posts
- 25 How big should a supercell be in phonon calculations?
- 14 How can I scan the whole PES of a bulk structure?
- 13 What does it mean if a strictly optimized experimental geometry presents imaginary frequencies?
- 10 What are the methods that can be used to ensure that an optimized geometry is a local minimum?
- 10 Are QMC calculations practical for periodic structure calculations?
- 10 Band structure with additive dispersion methods
- 10 I have access to 1000 cores across 10 nodes, what would be the best way to prallelize an MP2, GW, or RPA calculation for a periodic system in VASP?
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