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irrep
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modify `calc_gvectors()` in `__gvectors.py` and add examples for `vasp`
#17
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MIraola
closed
3 years ago
MIraola
commented
3 years ago
Make sure that the for in
calc_gvectors()
stops when as many plane waves as used in DFT have been generated (with
spinor
=F)
Add scalar and spinor examples for
vasp
Add tests for
vasp
examples
calc_gvectors()
stops when as many plane waves as used in DFT have been generated (withspinor
=F)vasp
vasp
examples