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Load pmsl pseudopotentials (for siesta) #63

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chrisjsewell opened this issue Dec 6, 2020 · 0 comments
Open

Load pmsl pseudopotentials (for siesta) #63

chrisjsewell opened this issue Dec 6, 2020 · 0 comments

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@chrisjsewell
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yep I will close. Although perhaps there should also be some automation for having these psuedopotentials loaded into aiida.

Currently, quantum-espresso pseudo families are loaded here: https://github.com/marvel-nccr/ansible-role-aiida/blob/master/tasks/aiida-pps.yml,
but I'm sure there is a way to make this a bit more "generic", possibly via https://github.com/aiidateam/aiida-pseudo

Originally posted by @chrisjsewell in marvel-nccr/ansible-role-siesta#3 (comment)

(Note, I think these can also be used for abinit)

@chrisjsewell chrisjsewell transferred this issue from marvel-nccr/ansible-role-siesta Dec 6, 2020
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