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lsmo-epfl / aiida-lsmo

AiiDA workflows for the LSMO laboratory at EPFL
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update input isotherm workchain in workflows.rst file #70

Closed mpougin closed 3 years ago

mpougin commented 3 years ago

In the updated version, the pressure_list input parameter of the isotherm workchain must not be defined if the automatic pressure point selection should be used. Defining "pressure_list": None results in ValueError

mpougin commented 3 years ago

@ltalirz thanks for your review. And yes, if I see it right it is also used in the MultiTemp WC (here, the documentation simply refers to the isotherm WC for the input, so no changes neccessary) and the IsothermInflection WC (the "pressure_list None," param in the Input details should be deleted here)