Related Issues (20)
- Add HSE06 AND pbe0
- Cannot parse selective dynamics POSCAR HOT 1
- Vasprun forces for single atom
- get_request_data is writing to location where permission could be denied HOT 2
- Delete plt.switch_backend("agg") in jarvis/jarvis/db/figshare.py HOT 1
- Error writing single atom poscar
- TBMBJ bandgap
- Fix JARVIS-STM app
- The VASP parameters of MBJ band gap calculations? HOT 1
- BadZipFile: File is not a zip file HOT 2
- Make the documentation page to include all colab notebooks
- Fix lightgbm version
- Discrepancy in the modulus calculated by elastic tensor and the ones directly obtained from the database HOT 2
- Primitive cell and conventional cell are inversed
- vooro_coord descriptor
- The bottom/top props appear to be incorrect for `Atoms.make_interface`
- HSE bandgap from vasprun.xml HOT 1
- Latest jarvis version has sklearn as mandatory dependency HOT 1
- hello how to run file idk help me pls
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