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pymatgen unknown version or path
monty 2024.10.21 /opt/deepmd-kit-2.2.1/lib/python3.10/site-packages/monty
ase 3.22.1 /opt/deepmd-kit-2.2.1/lib/python3.10/site-packages/ase
paramiko 3.5.0 /opt/deepmd-kit-2.2.1/lib/python3.10/site-packages/paramiko
custodian 2024.10.29 /opt/deepmd-kit-2.2.1/lib/python3.10/site-packages/custodian
Reference
Please cite:
Yuzhi Zhang, Haidi Wang, Weijie Chen, Jinzhe Zeng, Linfeng Zhang, Han Wang, and Weinan E,
DP-GEN: A concurrent learning platform for the generation of reliable deep learning
based potential energy models, Computer Physics Communications, 2020, 107206.
Description
Traceback (most recent call last):
File "/opt/deepmd-kit-2.2.1/bin/dpgen", line 8, in
sys.exit(main())
File "/opt/deepmd-kit-2.2.1/lib/python3.10/site-packages/dpgen/main.py", line 255, in main
args.func(args)
File "/opt/deepmd-kit-2.2.1/lib/python3.10/site-packages/dpgen/generator/run.py", line 5394, in gen_run
run_iter(args.PARAM, args.MACHINE)
File "/opt/deepmd-kit-2.2.1/lib/python3.10/site-packages/dpgen/generator/run.py", line 4736, in run_iter
run_model_devi(ii, jdata, mdata)
File "/opt/deepmd-kit-2.2.1/lib/python3.10/site-packages/dpgen/generator/run.py", line 2081, in run_model_devi
run_md_model_devi(iter_index, jdata, mdata)
File "/opt/deepmd-kit-2.2.1/lib/python3.10/site-packages/dpgen/generator/run.py", line 2053, in run_md_model_devi
raise RuntimeError(
RuntimeError: run_tasks for model_devi should not be empty! Please check your files.
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-
DeepModeling
Version: 0.12.1
Path: /opt/deepmd-kit-2.2.1/lib/python3.10/site-packages/dpgen
Dependency
pymatgen unknown version or path
monty 2024.10.21 /opt/deepmd-kit-2.2.1/lib/python3.10/site-packages/monty
ase 3.22.1 /opt/deepmd-kit-2.2.1/lib/python3.10/site-packages/ase
paramiko 3.5.0 /opt/deepmd-kit-2.2.1/lib/python3.10/site-packages/paramiko
custodian 2024.10.29 /opt/deepmd-kit-2.2.1/lib/python3.10/site-packages/custodian
Reference
Please cite:
Yuzhi Zhang, Haidi Wang, Weijie Chen, Jinzhe Zeng, Linfeng Zhang, Han Wang, and Weinan E,
DP-GEN: A concurrent learning platform for the generation of reliable deep learning
based potential energy models, Computer Physics Communications, 2020, 107206.
Description
Traceback (most recent call last):
File "/opt/deepmd-kit-2.2.1/bin/dpgen", line 8, in
sys.exit(main())
File "/opt/deepmd-kit-2.2.1/lib/python3.10/site-packages/dpgen/main.py", line 255, in main
args.func(args)
File "/opt/deepmd-kit-2.2.1/lib/python3.10/site-packages/dpgen/generator/run.py", line 5394, in gen_run
run_iter(args.PARAM, args.MACHINE)
File "/opt/deepmd-kit-2.2.1/lib/python3.10/site-packages/dpgen/generator/run.py", line 4736, in run_iter
run_model_devi(ii, jdata, mdata)
File "/opt/deepmd-kit-2.2.1/lib/python3.10/site-packages/dpgen/generator/run.py", line 2081, in run_model_devi
run_md_model_devi(iter_index, jdata, mdata)
File "/opt/deepmd-kit-2.2.1/lib/python3.10/site-packages/dpgen/generator/run.py", line 2053, in run_md_model_devi
raise RuntimeError(
RuntimeError: run_tasks for model_devi should not be empty! Please check your files.
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