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Dear Banduppy team,
When I am calculatting the unfolding band of MoS2 using Abinit 9.4.1 and Banduppy. The k-path.py and the WF file are obtained. However, when I run the banduppy script (k-path-su…
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Hi,
1) Is it possible tom do Fermi Surface unfolding using b4vasp ?
2) Can one get the Iso-surface for other energy cuts than Fermi level ?
3) Is the b4vasp works only with the VASP 6.0 or high…
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Dear @stepan-tsirkin and @paulovcmedeiros,
I have recently decided to use banduppy (I use it with QE 6.4), but firstly test it with different set ups. I have a couple of question, regarding the ou…
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Hi,
Is there any plan to support reading and writing rasters to/from R using the `raster` and `terra` packages?
For instance, if I have to read a raster from GRASS GIS and I want to use `terra` …
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TL;DR - ERC721s have a ton of creators and a few marketplaces, but no accepted means for transferring royalties from items being sold multiple times on secondary sales. This EIP is proposing a standar…
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I'm confused. went to do a new set of maps, and for some reason, they are ordered and named differently, and I don't have rotated maps corresponding with the cube map pattern. I'm using the same comma…
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Hi! My name is Nikita Rybin. I am a PhD student from Fritz-Haber institute. Recently, I became aware of bandup and decided to try it since my project is also related to band-unfolding. Since I had pro…
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Hello, @stepan-tsirkin!
I have a small question related to the normalization of the spectral function. When we use "density" option for plotting, the spectral function has intensity, which is not …
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AFAICS there is no way around to "split" a multiband raster, i.e. convert it to a data.frame, if one wants to predict on it - is that correct?
In `?predict.stars` I read:
> separate predictors i…
pat-s updated
3 years ago
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Your code is very helpful! Ihave a question whether it is supported in SOC calculation in VASP and provides band projection on specific element or orbitals?
Thank you!