Match comparison for Exchange energy (match type 30476)

Commits > Commit 0a2b0bf36feedeffb58bf70ad5882092a0f43b8a > Input 14-fullerene_unpacked.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-9.198639570000000e+01 4.600000000000000e-06 -9.198639560375001e+01 3.826694898021212e-07 -9.198639511499999e+01 8.750000048962647e-07 PASS

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Detailed information

Reference: -91.9863957, precision: 0.0000046
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -9.198639599000001e+01 -2.900000026784255e-07 -6.304347884313598e-02 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -9.198639599000001e+01 -2.900000026784255e-07 -6.304347884313598e-02 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -9.198639563000000e+01 6.999999868639861e-08 1.521739101878231e-02 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -9.198639573000000e+01 -2.999999537678377e-08 -6.521738125387777e-03 PASS
foss-serial-min: [foss2023a-serial] -9.198639578000000e+01 -7.999999240837496e-08 -1.739130269747282e-02 PASS
foss_cmake: [foss2022a-serial, foss-min] -9.198639590000001e+01 -2.000000023372195e-07 -4.347826137765641e-02 PASS
intel-serial: [intel2023a-serial] -9.198639554000000e+01 1.599999990276046e-07 3.478260848426188e-02 PASS
foss_cmake: [foss2022a-serial, foss-full] -9.198639590000001e+01 -2.000000023372195e-07 -4.347826137765641e-02 PASS
foss-serial-min: [foss2022a-serial] -9.198639578000000e+01 -7.999999240837496e-08 -1.739130269747282e-02 PASS
foss-serial-full: [foss2023b-serial] -9.198639578000000e+01 -7.999999240837496e-08 -1.739130269747282e-02 PASS
foss-serial-min: [foss2023b-serial] -9.198639578000000e+01 -7.999999240837496e-08 -1.739130269747282e-02 PASS
foss-opt-full: [foss2023a-serial] -9.198639590000001e+01 -2.000000023372195e-07 -4.347826137765641e-02 PASS
foss-serial-full: [foss2023a-serial] -9.198639578000000e+01 -7.999999240837496e-08 -1.739130269747282e-02 PASS
foss-serial-debug: [foss2023a-serial] -9.198639578000000e+01 -7.999999240837496e-08 -1.739130269747282e-02 PASS
intel_omp_autotools: [intel2022a-serial] -9.198639555000000e+01 1.500000053056283e-07 3.260869680557137e-02 PASS
foss-ppc: [foss2022a-serial] -9.198639550000000e+01 2.000000023372195e-07 4.347826137765641e-02 PASS
foss-omp-full: [foss2023a-serial] -9.198639579000000e+01 -9.000000034120603e-08 -1.956521746547957e-02 PASS
intel_omp_autotools: [intel2023a-serial] -9.198639586000000e+01 -1.599999990276046e-07 -3.478260848426188e-02 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -9.198639571000000e+01 -9.999993721976352e-09 -2.173911678690512e-03 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -9.198639561000000e+01 9.000000034120603e-08 1.956521746547957e-02 PASS
foss-mpi-opt-full: [foss2023a-mpi] -9.198639562000000e+01 8.000000661922968e-08 1.739130578678906e-02 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -9.198639554000000e+01 1.599999990276046e-07 3.478260848426188e-02 PASS
foss-mpi-full: [foss2023a-mpi] -9.198639545000000e+01 2.499999993688107e-07 5.434782594974145e-02 PASS
intel_mpi_autotools: [intel2023a-mpi] -9.198639557000000e+01 1.300000036508209e-07 2.826087035887410e-02 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -9.198639554000000e+01 1.599999990276046e-07 3.478260848426188e-02 PASS
foss-mpi-min: [foss2022a-mpi] -9.198639424000000e+01 1.460000007114104e-06 3.173913058943704e-01 PASS
foss-mpi-debug: [foss2023a-mpi] -9.198639559000000e+01 1.100000019960135e-07 2.391304391217684e-02 PASS
foss-mpi-min: [foss2023a-mpi] -9.198639424000000e+01 1.460000007114104e-06 3.173913058943704e-01 PASS
foss-mpi-omp-full: [foss2023a-mpi] -9.198639559999999e+01 1.000000082740371e-07 2.173913223348633e-02 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -9.198639564000000e+01 6.000000496442226e-08 1.304347934009180e-02 PASS
cuda-serial: [foss2022a-cuda-mpi] -9.198639541000000e+01 2.900000026784255e-07 6.304347884313598e-02 PASS
cuda-mpi-omp: [foss2022a-cuda-mpi] -9.198639559999999e+01 1.000000082740371e-07 2.173913223348633e-02 PASS