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- Wed Jan 23, 2019 5:58 pm
- Forum: Many-body perturbation theory
- Topic: exporting wave functions from abinit
- Replies: 0
- Views: 2593
exporting wave functions from abinit
Here are 3 questions : (1) We need all the wave functions of a converged plane wave abinit calculation for crystals of small unit cells. According to the link m early versions of abinit wrote the wave functions to a file in a simple way as …. cg(ii+index),ii=1,2*npw*nspinor) ... It should then be po...