dpdata icon indicating copy to clipboard operation
dpdata copied to clipboard

[BUG] only "VOLUME and BASIS-vectors are now included. "

Open HYEPIC opened this issue 2 years ago • 0 comments

Summary

When I used vasp's machine learning to simulate aimd, the structure obtained through his OUTCAR combined with dpdata was much less than the actual simulated structure, and I found that it was because only "VOLUME and BASIS-vectors are now included. "The image of the row will be extracted and I would be grateful if you would consider fixing the issue.

Steps to Reproduce

Further Information, Files, and Links

HYEPIC avatar Aug 09 '23 08:08 HYEPIC