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marvel-nccr / quantum-mobile

A Virtual Machine for computational materials science
https://quantum-mobile.readthedocs.io
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add EPW #104

Closed ltalirz closed 4 years ago

ltalirz commented 4 years ago

just do "make epw" and it should work (with the same parameters/env. as for PW).

ltalirz commented 4 years ago

actually, consider removing the wannier90 role from the playbook and simply using the w90 distributed with QE

@giovannipizzi What do you say?

ltalirz commented 4 years ago

added in https://github.com/marvel-nccr/ansible-role-quantum-espresso/commit/3d3ecf746ce71debf3c9395f9054d12dfbe29279