Related Issues (20)
- offer a KPOINTS option in the param.json HOT 1
- dpgen: AssertionError: cannot find coords HOT 2
- hard-coded model name in gromacs model devi calculation HOT 1
- [Feature Request] problem with “maybe the model devi is nan” HOT 2
- About running dpgen autotest on WSL ubuntu. Error occured
- 想问一下有关dpgen simplify的问题 HOT 1
- I would like to ask a question about the dpgen simplify function
- Error message needed to be revised HOT 1
- How do I restart a Task after it terminates unexpectedly? HOT 2
- [discuss] about perturb_scale function
- How to use diverse initial data set in "init_data_sys"
- How to use the DNN model obtained from DPGEN in LAMMPS? HOT 5
- [BUG] not support formats otherwise POSCAR when using shuffle_poscar
- ZBL CNtable.txt could not be found HOT 7
- Error about run.py with dpgen,UnboundLocalError: local variable 'fp_rest_accurate' referenced before assignment
- IndexError: list index out of range HOT 1
- [BUG] 同样的文件,在AMD9654+4090上训练报错,在intel8383C+4090上能正常提交 HOT 1
- DPGEN encountered the following issue while exploring the potential function of the PtNiMoO system. HOT 2
- When running dpgen, how can I add fparam after pair_style if I provide the lammps input file myself? HOT 3
- how does init_surf link the lattice parameters obtained from `init_bulk` HOT 1
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from dpgen.