deepmodeling / deepmodeling/DeePTB
Question about input parameters for the E3 case
Open
- Dominant language
- Python
- Stars
- 122
- Forks
- 36
- PR merge metrics
- No merged PRs in 30d
Description
### Details
What are the SLEM parameters for the Si case in the ICLR paper?
I am also curious about the settings for other materials like GaN and HfO₂.
Currently, the Hamiltonian error is at the level of 1e-2 eV, so I am not sure exactly what should be improved.
Contributor guide
Assessment
This issue has not been assessed yet.