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Problem
The GDI example command cannot run as written. It uses pb.josn instead of pb.json, calls python gdi.py from examples/gdi/ where no gdi.py exists, references machine.json that is not present in that directory, and pb.json points phase_i.equi_conf to beta.lmp while only alpha.lmp and bct.lmp are present locally.
cd examples/gdi
python gdi.py pb.josn machine.json -g gdidata.json
Expected result
Example commands should be copy-paste runnable from their documented directory, or clearly specify the required working directory and input files.
Source: Codex global repository scan of deepmodeling/dpti at commit b719828.
Project: DeepModeling Agent Code Scan
Problem
The GDI example command cannot run as written. It uses
pb.josninstead ofpb.json, callspython gdi.pyfromexamples/gdi/where nogdi.pyexists, referencesmachine.jsonthat is not present in that directory, andpb.jsonpointsphase_i.equi_conftobeta.lmpwhile onlyalpha.lmpandbct.lmpare present locally.Code references
dpti/examples/gdi/command.sh
Line 1 in b719828
dpti/examples/gdi/pb.json
Line 4 in b719828
dpti/examples/gdi/pb.json
Line 12 in b719828
Reproduction
Run:
cd examples/gdi python gdi.py pb.josn machine.json -g gdidata.jsonExpected result
Example commands should be copy-paste runnable from their documented directory, or clearly specify the required working directory and input files.