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Traceback (most recent call last):
File "/opt/mamba/bin/dpgen", line 8, in <module>
sys.exit(main())
File "/opt/mamba/lib/python3.10/site-packages/dpgen/main.py", line 255, in main
args.func(args)
File "/opt/mamba/lib/python3.10/site-packages/dpgen/data/gen.py", line 1583, in gen_init_bulk
coll_abacus_md(jdata)
File "/opt/mamba/lib/python3.10/site-packages/dpgen/data/gen.py", line 1245, in coll_abacus_md
_sys = dpdata.LabeledSystem(oo, type_map=type_map, fmt="abacus/md")
File "/opt/mamba/lib/python3.10/site-packages/dpdata/system.py", line 183, in __init__
self.from_fmt(
File "/opt/mamba/lib/python3.10/site-packages/dpdata/system.py", line 220, in from_fmt
return self.from_fmt_obj(load_format(fmt), file_name, **kwargs)
File "/opt/mamba/lib/python3.10/site-packages/dpdata/system.py", line 1113, in from_fmt_obj
data = fmtobj.from_labeled_system(file_name, **kwargs)
File "/opt/mamba/lib/python3.10/site-packages/dpdata/plugins/abacus.py", line 66, in from_labeled_system
return dpdata.abacus.md.get_frame(file_name)
File "/opt/mamba/lib/python3.10/site-packages/dpdata/abacus/md.py", line 175, in get_frame
coords, cells, force, stress = get_coords_from_dump(dumplines, natoms)
File "/opt/mamba/lib/python3.10/site-packages/dpdata/abacus/md.py", line 88, in get_coords_from_dump
np.array([float(i) for i in dumplines[iline + 3 + ix].split()[0:3]])
File "/opt/mamba/lib/python3.10/site-packages/dpdata/abacus/md.py", line 88, in <listcomp>
np.array([float(i) for i in dumplines[iline + 3 + ix].split()[0:3]])
ValueError: could not convert string to float: 'LATTICE_CONSTANT:'
The error message show that the function of dpdata to get value from MD is destroyed.
Additional Context
No response
Task list for Issue attackers (only for developers)
Understand the testing issue described by the developer.
Review the specific test case, expected and actual results, and any error messages.
Identify the root cause of the test failure or issue.
If a possible solution is suggested, evaluate its feasibility and effectiveness.
Implement a fix for the test failure or issue, or create a new test case if needed.
Verify that the fix resolves the testing issue and the test case passes.
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The text was updated successfully, but these errors were encountered:
mohanchen
changed the title
The weekly test of interface to dpgen is failed at 20241016
The weekly test of interface to DPGEN is failed at 20241016
Oct 17, 2024
Describe the Testing Issue
At 20241016, the test of interface to dpgen is failed.
https://app.bohrium.dp.tech/abacustest/?request=GET%3A%2Fapplications%2Fabacustest%2Fjobs%2Fsched-abacustest-interface-test-ade2fe
The error message is:
The error message show that the function of dpdata to get value from MD is destroyed.
Additional Context
No response
Task list for Issue attackers (only for developers)
The text was updated successfully, but these errors were encountered: