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- Wed Jan 03, 2018 10:46 am
- Forum: Response calculations
- Topic: GW-calculations of graphene
- Replies: 0
- Views: 2456
GW-calculations of graphene
Hello, I am trying to calculate the band opening of graphene at the K-point under a uniaxial strain in graphene. I already calculated these using LDA. However, I want to improve the results for the band gap by performing GW calculations. I followed the tutorial regarding GW calculations and calculat...