Related Issues (20)
- QUIPPY installation issue
- SYSTEM ABORT: Traceback (most recent call last) File "/io/QUIP/src/GAP/gp_predict.f95", line 485 kind unspecified HOT 7
- gap_fit MPI Segmentation fault HOT 20
- Let's have the makefiles cry with very old compiler versions HOT 1
- gap_si_surface.ipynb: runtime error about dftb-params.xml HOT 1
- angle_3b not MPI ready HOT 2
- Empty output file from quip command HOT 37
- SYSTEM ABORT: Database was created with a later version of the code. (in LAMMPS) HOT 2
- LAMMPS + QUIP HOT 1
- Why is it possible to use multiple descriptors in the gap_fit command? HOT 2
- Python 3.12 support HOT 5
- "Iterative GAP fitting" example using ase Vasp calculator HOT 3
- potential parameters file HOT 4
- Error in Installing QUIP/GAP HOT 5
- Tutorial Issue - dynamics.run() HOT 1
- make libquip.a fails on GCC-14 (darwin_arm64_gfortran) HOT 2
- RuntimeError in running the tutorial notebook HOT 8
- Questions on gap_fit tutorial HOT 3
- Can't compile quippy HOT 1
- gap_fit config_file with carriage returns breaks writing of potential HOT 18
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