Match comparison for Born charge diff w=0.1 (match type 23047)

Commits > Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc > Input 04-silicon.03-emresp.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.954800000000000e+00 1.480000000000000e-05 -2.946999875000000e+00 2.063477889048911e-02 -2.923542000000000e+00 3.125800000000001e-02 FAIL

Checks for this match

  • MPI builders have different values.
  • GPU builders have different values.
  • Mid point of values far away from reference. Recentering may be necessary.
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Detailed information

Reference: -2.9548, precision: 0.0000148
Run Value Difference Relative difference Status
intel-serial: [intel2023a-serial] -2.954799000000000e+00 1.000000000139778e-06 6.756756757701202e-02 PASS
foss-serial: [foss2023a-serial] -2.954799000000000e+00 1.000000000139778e-06 6.756756757701202e-02 PASS
foss-serial-debug: [foss2023a-serial] -2.954799000000000e+00 1.000000000139778e-06 6.756756757701202e-02 PASS
intel-min-parallel: [intel2022a-mpi] -2.954799000000000e+00 1.000000000139778e-06 6.756756757701202e-02 PASS
ppc: [foss2023a-serial] -2.954800000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
autotools_foss_mpi_omp: [foss2023a-mpi] -2.954799000000000e+00 1.000000000139778e-06 6.756756757701202e-02 PASS
foss-parallel-debug: [foss2023a-mpi] -2.954799000000000e+00 1.000000000139778e-06 6.756756757701202e-02 PASS
intel-parallel: [intel2023a-mpi] -2.954799000000000e+00 1.000000000139778e-06 6.756756757701202e-02 PASS
foss-parallel: [foss2023a-mpi] -2.954799000000000e+00 1.000000000139778e-06 6.756756757701202e-02 PASS
foss-min-parallel: [foss2023b-mpi] -2.954799000000000e+00 1.000000000139778e-06 6.756756757701202e-02 PASS
autotools_intel_mpi_omp: [intel2023a-mpi] -2.954799000000000e+00 1.000000000139778e-06 6.756756757701202e-02 PASS
address-sanitizer: [foss2023a-serial, ci-foss-full] -2.954799000000000e+00 1.000000000139778e-06 6.756756757701202e-02 PASS
intel-serial-debug: [intel2023a-serial] -2.954799000000000e+00 1.000000000139778e-06 6.756756757701202e-02 PASS
intel-parallel-debug: [intel2023a-mpi] -2.954799000000000e+00 1.000000000139778e-06 6.756756757701202e-02 PASS
cuda: [foss2022a-cuda-mpi, ci-foss-full-cuda] -2.892284000000000e+00 6.251600000000002e-02 4.224054054054055e+03 FAIL
cuda: [foss2022a-cuda-mpi, ci-foss-full-mpi-omp-cuda] -2.892527000000000e+00 6.227300000000024e-02 4.207635135135151e+03 FAIL