`read_abinit_WFK` does not store k-points

brainandforce / Electrum.jl

A Julian toolkit for solid-state chemical theory.

MIT License

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`read_abinit_WFK` does not store k-points #191

Closed brainandforce closed 1 year ago

brainandforce commented 1 year ago

I've noticed that when read_abinit_WFK is called, the k-points are simply missing from the data, all of them being the zero vector with weight 1. There are some issues with the way PlanewaveWavefunction is implemented, and the fix will involve some refactoring of that code.