Search found 1 match
- Sat Sep 11, 2021 1:37 pm
- Forum: Running the code
- Topic: Cartesian at the end of epw1.in file
- Replies: 1
- Views: 2336
Cartesian at the end of epw1.in file
This is my first time using EPW code. I want do the mobility calculation for CsGeBr3. I have so far completed the scf, ph and nscf calculations. But for the first epw1.in file, I got confused. In the tutorial files there are: 4 cartesian 0.000000000 -0.333333333 0.000000000 0.666666667 0.000000000 0...