Match comparison for External energy (match type 30479)

Commits > Commit 705c4760eef009c58a165e8716adc8057257a566 > Input 14-fullerene_unpacked.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-8.134092172240000e+03 6.310000000000000e-05 -8.134092179187812e+03 1.136422848741202e-05 -8.134092171340000e+03 1.668000004428905e-05 PASS
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Detailed information

Reference: -8134.09217224, precision: 0.0000631
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -8.134092168150000e+03 4.089999492862262e-06 6.481774156675534e-02 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -8.134092168150000e+03 4.089999492862262e-06 6.481774156675534e-02 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -8.134092186920000e+03 -1.468000027671224e-05 -2.326465970952810e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -8.134092185970000e+03 -1.373000031890115e-05 -2.175911302519992e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] -8.134092160920000e+03 1.131999943027040e-05 1.793977722705293e-01 PASS
foss-serial-min: [foss2023a-serial] -8.134092185340000e+03 -1.309999970544595e-05 -2.076069683905856e-01 PASS
foss-serial-min: [foss2022a-serial] -8.134092185340000e+03 -1.309999970544595e-05 -2.076069683905856e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -8.134092160920000e+03 1.131999943027040e-05 1.793977722705293e-01 PASS
foss-serial-min: [foss2023b-serial] -8.134092185340000e+03 -1.309999970544595e-05 -2.076069683905856e-01 PASS
foss-serial-full: [foss2023b-serial] -8.134092185340000e+03 -1.309999970544595e-05 -2.076069683905856e-01 PASS
foss-serial-full: [foss2023a-serial] -8.134092185340000e+03 -1.309999970544595e-05 -2.076069683905856e-01 PASS
intel-serial: [intel2023a-serial] -8.134092186120000e+03 -1.388000055158045e-05 -2.199683130202924e-01 PASS
foss-opt-full: [foss2023a-serial] -8.134092160920000e+03 1.131999943027040e-05 1.793977722705293e-01 PASS
foss-ppc: [foss2022a-serial] -8.134092187580000e+03 -1.534000057290541e-05 -2.431061897449352e-01 PASS
foss-serial-debug: [foss2023a-serial] -8.134092185340000e+03 -1.309999970544595e-05 -2.076069683905856e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -8.134092187080000e+03 -1.484000040363753e-05 -2.351822567929878e-01 PASS
intel_omp_autotools: [intel2022a-serial] -8.134092187790000e+03 -1.555000017106067e-05 -2.464342340897096e-01 PASS
foss-mpi-opt-full: [foss2023a-mpi] -8.134092187620000e+03 -1.538000014988938e-05 -2.437400974625893e-01 PASS
intel_omp_autotools: [intel2023a-serial] -8.134092182770000e+03 -1.053000050887931e-05 -1.668779795384994e-01 PASS
foss-omp-full: [foss2023a-serial] -8.134092158120000e+03 1.411999983247370e-05 2.237717881533074e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -8.134092171670000e+03 5.699994289898314e-07 9.033271457842018e-03 PASS
foss-mpi-full: [foss2023a-mpi] -8.134092187640000e+03 -1.539999993838137e-05 -2.440570513214163e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -8.134092187860000e+03 -1.562000034027733e-05 -2.475435870091494e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -8.134092187860000e+03 -1.562000034027733e-05 -2.475435870091494e-01 PASS
cuda-serial: [foss2022a-cuda-mpi] -8.134092182330000e+03 -1.008999970508739e-05 -1.599049081630332e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -8.134092186770000e+03 -1.453000004403293e-05 -2.302694143269878e-01 PASS
foss-mpi-min: [foss2023a-mpi] -8.134092154660000e+03 1.757999962137546e-05 2.786053822721943e-01 PASS
foss-mpi-debug: [foss2023a-mpi] -8.134092176480000e+03 -4.239999725541566e-06 -6.719492433504858e-02 PASS
foss-mpi-min: [foss2022a-mpi] -8.134092154660000e+03 1.757999962137546e-05 2.786053822721943e-01 PASS
foss-mpi-omp-full: [foss2023a-mpi] -8.134092187720000e+03 -1.548000000184402e-05 -2.453248811702697e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -8.134092187270000e+03 -1.503000021330081e-05 -2.381933472789352e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -8.134092188020000e+03 -1.578000046720263e-05 -2.500792467068562e-01 PASS