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[PyBigDFT] Adjust band structure for supercells with non periodic directions.

Damien Caliste requested to merge work/bandStructure into devel

Use a large size in case of non periodic direction, instead of 1. Like that ASE is not discretising any path along that direction. Like that, the graphene band structure is nice ;) Update also two calls to the ASE latest convention (at least the one in Ubuntu 20.04), to avoid warnings.

Also simplify a bit the code part to generate the evals(kpt) mesh for the interpolator.

@luigigenovese any remark ?

Before :before

After :after

Edited by Damien Caliste

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