Match comparison for Hartree energy (match type 26101)

Commits > Commit fb3b67f6830f0e047754886f078a46875acffbf8 > Input 18-TiO2.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
4.244778686000000e+01 1.500000000000000e-06 4.244778735038463e+01 5.030023772308267e-07 4.244778747500000e+01 6.150000011473367e-07 PASS

Checks for this match

  • Mid point of values far away from reference. Recentering may be necessary.
Loading plot...
Get updated match line Get updated match line with fixed reference

Detailed information

Reference: 42.44778686, precision: 0.0000015
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, ci-foss-full] 4.244778804000000e+01 1.179999998157655e-06 7.866666654384364e-01 PASS
foss-cmake-zen4: [foss2023a-serial, ci-foss-min] 4.244778799000000e+01 1.130000001126064e-06 7.533333340840423e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, ci-foss-min-mpi] 4.244778686000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-opt-full: [foss2023a-serial] 4.244778686000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-full: [foss2023a-serial] 4.244778686000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-full: [foss2023b-serial] 4.244778686000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-cmake-zen4: [foss2023a-mpi, ci-foss-full-mpi] 4.244778698000000e+01 1.199999957179898e-07 7.999999714532653e-02 PASS
foss-ppc: [foss2022a-serial] 4.244778757000000e+01 7.100000019022445e-07 4.733333346014963e-01 PASS
intel_omp_autotools: [intel2022a-serial] 4.244778701000000e+01 1.499999982002009e-07 9.999999880013395e-02 PASS
foss-serial-min: [foss2023a-serial] 4.244778809000000e+01 1.230000002294673e-06 8.200000015297821e-01 PASS
intel_omp_autotools: [intel2023a-serial] 4.244778699000000e+01 1.299999965453935e-07 8.666666436359567e-02 PASS
foss-serial-min: [foss2023b-serial] 4.244778809000000e+01 1.230000002294673e-06 8.200000015297821e-01 PASS
foss-serial-debug: [foss2023a-serial] 4.244778686000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-omp-full: [foss2023a-serial] 4.244778695000000e+01 9.000000034120603e-08 6.000000022747069e-02 PASS
foss-mpi-full: [foss2023a-mpi] 4.244778779000000e+01 9.299999987888441e-07 6.199999991925628e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] 4.244778696000000e+01 1.000000011686097e-07 6.666666744573983e-02 PASS
foss-mpi-debug: [foss2023a-mpi] 4.244778779000000e+01 9.299999987888441e-07 6.199999991925628e-01 PASS
foss-mpi-min: [foss2023a-mpi] 4.244778700000000e+01 1.399999973727972e-07 9.333333158186481e-02 PASS
intel-serial: [intel2023a-serial] 4.244778693000000e+01 6.999999868639861e-08 4.666666579093241e-02 PASS
foss-mpi-opt-full: [foss2023a-mpi] 4.244778779000000e+01 9.299999987888441e-07 6.199999991925628e-01 PASS
foss-mpi-omp-full: [foss2023a-mpi] 4.244778693000000e+01 6.999999868639861e-08 4.666666579093241e-02 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] 4.244778799000000e+01 1.130000001126064e-06 7.533333340840423e-01 PASS
foss-serial-min: [foss2022a-serial] 4.244778809000000e+01 1.230000002294673e-06 8.200000015297821e-01 PASS
foss-mpi-min: [foss2022a-mpi] 4.244778700000000e+01 1.399999973727972e-07 9.333333158186481e-02 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] 4.244778691000000e+01 4.999999703159119e-08 3.333333135439413e-02 PASS
cuda-serial: [foss2022a-cuda-mpi] 4.244778792000000e+01 1.060000002439665e-06 7.066666682931100e-01 PASS