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Fix incorrect unit label when plotting #26

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lucydot opened this issue Dec 14, 2022 · 0 comments
Open

Fix incorrect unit label when plotting #26

lucydot opened this issue Dec 14, 2022 · 0 comments
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@lucydot
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lucydot commented Dec 14, 2022

When we run e.g.

reaction.Dmu(xc='scan').plot_TvsP(scale_range=[-2,-1])

the energy scale legend shows kJ/mol but the energy is actually in eV by default.

Specifying units gives correct result:

reaction.Dmu(units="kJ",xc='scan').plot_TvsP(scale_range=[-2,-1])

A Must Fix. Ideally the plot would detect what units the energy is in and then label appropriately.

@lucydot lucydot added the bug Something isn't working label Dec 14, 2022
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