Match comparison for External energy (match type 30479)

Commits > Commit f72050fe95608e153e1887ef05d1ad42dc082fde > Input 14-fullerene_unpacked.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-8.134092172240000e+03 6.310000000000000e-05 -8.134092179839376e+03 1.134817286736429e-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-serial-min: [foss2023a-serial] -8.134092185340000e+03 -1.309999970544595e-05 -2.076069683905856e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -8.134092187610000e+03 -1.537000025564339e-05 -2.435816205331758e-01 PASS
foss-serial-min: [foss2022a-serial] -8.134092185340000e+03 -1.309999970544595e-05 -2.076069683905856e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -8.134092185970000e+03 -1.373000031890115e-05 -2.175911302519992e-01 PASS
foss-serial-full: [foss2023b-serial] -8.134092185340000e+03 -1.309999970544595e-05 -2.076069683905856e-01 PASS
foss-serial-min: [foss2023b-serial] -8.134092185340000e+03 -1.309999970544595e-05 -2.076069683905856e-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-full: [foss2023a-serial] -8.134092185340000e+03 -1.309999970544595e-05 -2.076069683905856e-01 PASS
foss-serial-debug: [foss2023a-serial] -8.134092185340000e+03 -1.309999970544595e-05 -2.076069683905856e-01 PASS
intel_omp_autotools: [intel2023a-serial] -8.134092182770000e+03 -1.053000050887931e-05 -1.668779795384994e-01 PASS
intel_omp_autotools: [intel2022a-serial] -8.134092187790000e+03 -1.555000017106067e-05 -2.464342340897096e-01 PASS
foss-omp-full: [foss2023a-serial] -8.134092158120000e+03 1.411999983247370e-05 2.237717881533074e-01 PASS
foss-mpi-full: [foss2023a-mpi] -8.134092187630000e+03 -1.539000004413538e-05 -2.438985743920028e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -8.134092187700000e+03 -1.546000021335203e-05 -2.450079273114427e-01 PASS
intel-serial: [intel2023a-serial] -8.134092186120000e+03 -1.388000055158045e-05 -2.199683130202924e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] -8.134092160920000e+03 1.131999943027040e-05 1.793977722705293e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -8.134092160920000e+03 1.131999943027040e-05 1.793977722705293e-01 PASS
foss-mpi-opt-full: [foss2023a-mpi] -8.134092187300000e+03 -1.505999989603879e-05 -2.386687780671757e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -8.134092187400000e+03 -1.515999974799342e-05 -2.402535617748562e-01 PASS
foss-mpi-debug: [foss2023a-mpi] -8.134092185960000e+03 -1.372000042465515e-05 -2.174326533225856e-01 PASS
foss-mpi-min: [foss2022a-mpi] -8.134092154660000e+03 1.757999962137546e-05 2.786053822721943e-01 PASS
foss-mpi-min: [foss2023a-mpi] -8.134092154660000e+03 1.757999962137546e-05 2.786053822721943e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -8.134092182570000e+03 -1.032999989547534e-05 -1.637083977095933e-01 PASS
foss-mpi-omp-full: [foss2023a-mpi] -8.134092187650000e+03 -1.540999983262736e-05 -2.442155282508298e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -8.134092187860000e+03 -1.562000034027733e-05 -2.475435870091494e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -8.134092187860000e+03 -1.562000034027733e-05 -2.475435870091494e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -8.134092188020000e+03 -1.578000046720263e-05 -2.500792467068562e-01 PASS
cuda-serial: [foss2022a-cuda-mpi] -8.134092182330000e+03 -1.008999970508739e-05 -1.599049081630332e-01 PASS
cuda-mpi-omp: [foss2022a-cuda-mpi] -8.134092186200000e+03 -1.395999970554840e-05 -2.212361284556006e-01 PASS