Match comparison for External energy (match type 30479)

Commits > Commit 968a3ff7080ffa1f89f08d37efc7416527769dec > Input 14-fullerene_unpacked.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-8.134092172240000e+03 2.120000000000000e-05 -8.134092180394668e+03 1.128106770262971e-05 -8.134092171350000e+03 1.668999993853504e-05 PASS
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Detailed information

Reference: -8134.09217224, precision: 0.0000212
Run Value Difference Relative difference Status
foss_cmake: [foss2022a-serial, foss-min] -8.134092160920000e+03 1.131999943027040e-05 5.339622372769056e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -8.134092160920000e+03 1.131999943027040e-05 5.339622372769056e-01 PASS
foss_min_autotools: [foss2023a-serial] -8.134092185340000e+03 -1.309999970544595e-05 -6.179245144078279e-01 PASS
foss_min_autotools: [foss2023b-serial] -8.134092185340000e+03 -1.309999970544595e-05 -6.179245144078279e-01 PASS
foss_min_autotools: [foss2022a-serial] -8.134092185340000e+03 -1.309999970544595e-05 -6.179245144078279e-01 PASS
foss_opt_autotools: [foss2023a-serial] -8.134092160920000e+03 1.131999943027040e-05 5.339622372769056e-01 PASS
foss_autotools: [foss2023a-serial] -8.134092185340000e+03 -1.309999970544595e-05 -6.179245144078279e-01 PASS
foss_autotools: [foss2023b-serial] -8.134092185340000e+03 -1.309999970544595e-05 -6.179245144078279e-01 PASS
foss_autotools: [foss2022a-serial] -8.134092185340000e+03 -1.309999970544595e-05 -6.179245144078279e-01 PASS
intel_autotools: [intel2023a-serial] -8.134092186120000e+03 -1.388000055158045e-05 -6.547170071500212e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -8.134092185870000e+03 -1.363000046694651e-05 -6.429245503276657e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -8.134092187450000e+03 -1.521000012871809e-05 -7.174528362602874e-01 PASS
foss_mpi_min_autotools: [foss2022a-mpi] -8.134092154660000e+03 1.757999962137546e-05 8.292452651592200e-01 PASS
foss_mpi_min_autotools: [foss2023a-mpi] -8.134092154660000e+03 1.757999962137546e-05 8.292452651592200e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -8.134092187910000e+03 -1.566999981150730e-05 -7.391509345050611e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -8.134092177570000e+03 -5.330000021785963e-06 -2.514150953672624e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -8.134092187480000e+03 -1.523999981145607e-05 -7.188679156347204e-01 PASS
foss_omp_autotools: [foss2023a-serial] -8.134092158120000e+03 1.411999983247370e-05 6.660377279468724e-01 PASS
foss_mpi_autotools: [foss2023a-mpi] -8.134092187640000e+03 -1.539999993838137e-05 -7.264150914330835e-01 PASS
intel_omp_autotools: [intel2023a-serial] -8.134092182770000e+03 -1.053000050887931e-05 -4.966981372112882e-01 PASS
foss_mpi_autotools: [foss2022a-mpi] -8.134092187730000e+03 -1.548999989609001e-05 -7.306603724570760e-01 PASS
intel_omp_autotools: [intel2022a-serial] -8.134092187790000e+03 -1.555000017106067e-05 -7.334905741066355e-01 PASS
foss_debug_autotools: [foss2023a-serial] -8.134092185340000e+03 -1.309999970544595e-05 -6.179245144078279e-01 PASS
foss_ppc_autotools: [foss2022a-serial] -8.134092187580000e+03 -1.534000057290541e-05 -7.235849326842174e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -8.134092187410000e+03 -1.517000055173412e-05 -7.155660637610434e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -8.134092187850000e+03 -1.561000044603134e-05 -7.363207757561950e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -8.134092182330000e+03 -1.008999970508739e-05 -4.759433823154431e-01 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -8.134092184850000e+03 -1.261000033991877e-05 -5.948113367886212e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -8.134092188040000e+03 -1.580000025569461e-05 -7.452830309289912e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -8.134092187870000e+03 -1.563000023452332e-05 -7.372641620058171e-01 PASS