search

vasp-dev / py4vasp

Python interface for VASP
https://vasp.at/py4vasp/latest/
Apache License 2.0
79 stars 20 forks source link

Implement Contour plots #155

Closed martin-schlipf closed 7 months ago

martin-schlipf commented 7 months ago

Sometimes it can provide insight to visualize 3d data as a 2d slice. For this contour plots would be a nice feature. The simplest plot could just take a plane of the regular grid but a more throughout implementation could use scipy.interpolate.griddata to get any arbitrary points on a regular grid. To achieve this, we should introduce a new class analogous to Series. We should decide whether to allow multiple contours in a single Graph or not. Contours could either be an independent field or members of the Series list.

martin-schlipf commented 7 months ago

Initial implementation for densities