Why do I get the following error when running code to draw DOS

DerekDardzinski / vaspvis

A highly flexible and customizable library for visualizing electronic structure data from VASP calculations.

MIT License

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Why do I get the following error when running code to draw DOS #9

Open spe-or-feed opened 11 months ago

spe-or-feed commented 11 months ago

File "/public/home/xuyk/.conda/envs/vaspvis/lib/python3.9/site-packages/vaspvis/dos.py", line 382, in _load_pdos pdos = pdos[:, :, [(j * 4) + 4 for j in range(16)]] IndexError: index 40 is out of bounds for axis 2 with size 37

spe-or-feed commented 11 months ago

Ps: I used dos.py normally when plotting 2D CrI3 with fewer atoms, but this error occurs when drawing 3D NdFe14B, is it because NdFeB has too many atoms?