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Currently our `file` entry type has a 1-to-1 mapping with a file on disk, however there are many cases where databases serve archive files that aggregate data on multiple structures. I would like to b…
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(From Issue #27, @cai-xiaomeng)
Hi!
Does Effmass support supercell band data (band folding) processing?
I already do the band unfolding of supercell by using BandUp program, now how to use E…
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Hi, i'm trying to plot the weyl semimetal band structure
Firstly, I'm using pyprocar with quantum espresso
Using the bands.in, I succeeded in creating the band plot I wanted.
**bands.in
K_POINTS …
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Currently the `BandsData` does not contain the Fermi level, as far as I know. Since this is quite an integral quantity to interpreting the band structure, and typically band structures are plotted by …
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Bonjour
Lors de l'intégration du bloc A du PCRS Hauts-de-France, l'ensemble des 2098 dalles sort en erreur du scan.
Le soucis est probablement lié à celui de #414
Pour information, voici le gd…
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The current Yaehmop features only support band structures.
https://github.com/psavery/avogadro/tree/yaehmop
Supports:
- [ ] density of states
- [ ] band structures
- [ ] partial density of …
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### What is the bug or the crash?
That raster has 5000 bands, but QGIS only …
latot updated
2 weeks ago
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I couldn't help but notice that Saturn parts have a lot fewer paintjob options than the others. Many don't have any alternatives at all, particularly adapters, which, when making an unusual design, so…
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Hello Dr. Ikeda,
I am doing band unfolding calculation using upho. I am getting an error something like this:
Calculate weights for wavevectors (sec.): 0.0002
Traceback (most recent call…
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Hello
I hope you are doing well.
I'm trying to calculate the berry phase around a nodal point at Gamma in a hexagonal BZ. My code below should work as per my understanding of z2pack and previo…