Nick Papior

Ok, great. Hadn't seen that one. 👍

A is not symmetric?

Not that I have a solution but it is the routine `DGEQRF` that gets the wrong argument (not `dsyevr_2stage`). This suggests an erroneous work-array allocation that is passed through the...

I have fixed the bug (it was due to missing conversions in the old #177). This should clear out the remaining calls. I have tested this small snippet which fails...

This should be solved now in #271/#272 @uihsnv could you please try with the latest commits?

Ok, thanks for your insights.

This would be nice! :)

Perhaps another more clear way would be to allow repo2docker to not initialise certain submodules. I.e. a configuration file to determine which sub-modules should be initialised, and optionally whether that...

> I think it is good (and relatively short) as it is. In the literature I see mostly the formulation "graphene nanoribbon heterojunctions" for these structures. Other possibilities could therefore...

> That's why I only allow imaginary numbers in these two cases. We could provide an extra field to specify this change instead of using this notation, but as I...