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You do not need to put in anything here :)
Just open the issue by clicing the green "Submit new issue" and within 10-15s a message instructing you do upload your files should appear!
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You do not need to put in anything here :)
Just open the issue by clicing the green "Submit new issue" and within 10-15s a message instructing you do upload your files should appear!
-
You do not need to put in anything here :)
Just open the issue by clicing the green "Submit new issue" and within 10-15s a message instructing you do upload your files should appear!
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Hello Mr.
When I downloaded the script I found that the POSCAR atoms were superimposed, as shown in Figure 1.
 from the bulk relaxed orderings.
this should be doable with `pymatgen` as…
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I'm learning to use wanniertool and I found the biggest problem is getting the correct structure. I ran the example of Bi2Se3 and can easily get correct results. There's also no problem with the wt.in…
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In order to develop representations for solids, we need a framework to parse csf files (maybe some others like poscar in the future?)
This requires creating a `cell` or `crystal` class that inheri…
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I have downloaded WxDragon to visualize vibrations computed with VASP, but, when I try to open an OUTCAR file (either an OUTCAR resulting from a geometry optimization or from a frequency calculation),…
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It would be nice if multiple modes could be animated simultaneously, like [this example](https://www.youtube.com/watch?v=dGVaU3o3Ve4). There is a primitive implementation (which reads from the phonopy…