Dominik Gresch

Tagging @ltalirz

If we can't fix them, maybe we should mark them as slow so they can easily be deselected? Reference: https://docs.pytest.org/en/latest/mark.html

> > Before implementing the rest (and settling all the naming), there is one more fundamental question we should answer. Currently, the implementation will return all paths that match the...

> Is there a way around this error Not that I'm aware of, unfortunately. This is probably not a fundamental limitation, just that no one has taken the time to...

Probably fixed by `fsc.iohelper` update. Still needs updating of the direct `msgpack-python` dependency (changed to `msgpack`).

For the Z2 invariant, the chosen surface should only cover half the Brillouin zone (between two time-reversal invariant lines). If it covers the whole Brillouin zone (as with `lambda s,t2:...

It's been a while since I installed either ABINIT or VASP - do they come with a native interface to the latest Wannier90 version? If the Wannier90 version used accepts...

For Quantum Espresso, there's no need to use special setup instructions. An example with `wannier90_full` can be found here: https://github.com/Z2PackDev/Z2Pack/blob/dev/current/examples/fp/espresso/6.2/Bi/run.py For Siesta, @juijan provided an example using the `sisl` library:...

> The result of Z2 is 0 for both while when POSCAR is: > > > 2.0714999999999995 1.1959810826263095 9.545333333 > > 2.0714999999999995 1.1959810826263095 9.545333333 > > 0.0000000000000000 -2.3919621652526191 9.545333333 >...

It may or may not be important, but the volume for the second unit cell is quite a bit lower for the second unit cell -- are you sure the...