Match comparison for Exchange energy (match type 21130)

Commits > Commit c9606f298ccf4e57d14167459d26815f7508aa3e > Input 22-berry.02-cubic_Si.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.259799677000000e+01 1.690000000000000e-02 -1.260195312300000e+01 4.390233992560807e-04 -1.260081192500000e+01 1.223014999999883e-03 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: -12.59799677, precision: 0.0169
Run Value Difference Relative difference Status
foss_cmake: [foss2022a-serial, foss-min] -1.260203494000000e+01 -4.038169999999397e-03 -2.389449704141655e-01 PASS
foss_min_autotools: [foss2023a-serial] -1.260203494000000e+01 -4.038169999999397e-03 -2.389449704141655e-01 PASS
foss_min_autotools: [foss2022a-serial] -1.260203494000000e+01 -4.038169999999397e-03 -2.389449704141655e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -1.260203494000000e+01 -4.038169999999397e-03 -2.389449704141655e-01 PASS
foss_min_autotools: [foss2023b-serial] -1.260203494000000e+01 -4.038169999999397e-03 -2.389449704141655e-01 PASS
foss_autotools: [foss2023a-serial] -1.260203494000000e+01 -4.038169999999397e-03 -2.389449704141655e-01 PASS
foss_opt_autotools: [foss2023a-serial] -1.260203494000000e+01 -4.038169999999397e-03 -2.389449704141655e-01 PASS
foss_autotools: [foss2023b-serial] -1.260203494000000e+01 -4.038169999999397e-03 -2.389449704141655e-01 PASS
foss_autotools: [foss2022a-serial] -1.260203494000000e+01 -4.038169999999397e-03 -2.389449704141655e-01 PASS
intel_autotools: [intel2023a-serial] -1.260203441000000e+01 -4.037639999999953e-03 -2.389136094674529e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -1.260203469000000e+01 -4.037920000000028e-03 -2.389301775147946e-01 PASS
foss_mpi_min_autotools: [foss2023a-mpi] -1.260203469000000e+01 -4.037920000000028e-03 -2.389301775147946e-01 PASS
foss_mpi_min_autotools: [foss2022a-mpi] -1.260203469000000e+01 -4.037920000000028e-03 -2.389301775147946e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -1.260203437000000e+01 -4.037600000000197e-03 -2.389112426035619e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -1.260203469000000e+01 -4.037920000000028e-03 -2.389301775147946e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -1.260203437000000e+01 -4.037600000000197e-03 -2.389112426035619e-01 PASS
foss_debug_autotools: [foss2023a-serial] -1.260203494000000e+01 -4.038169999999397e-03 -2.389449704141655e-01 PASS
foss_omp_autotools: [foss2023a-serial] -1.260203480000000e+01 -4.038030000000248e-03 -2.389366863905472e-01 PASS
intel_omp_autotools: [intel2022a-serial] -1.260203454000000e+01 -4.037770000000052e-03 -2.389213017751510e-01 PASS
foss_mpi_autotools: [foss2023a-mpi] -1.260203437000000e+01 -4.037600000000197e-03 -2.389112426035619e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -1.260203437000000e+01 -4.037600000000197e-03 -2.389112426035619e-01 PASS
intel_omp_autotools: [intel2023a-serial] -1.260203454000000e+01 -4.037770000000052e-03 -2.389213017751510e-01 PASS
foss_ppc_autotools: [foss2022a-serial] -1.260203438000000e+01 -4.037609999999248e-03 -2.389118343194821e-01 PASS
foss_mpi_autotools: [foss2022a-mpi] -1.260203437000000e+01 -4.037600000000197e-03 -2.389112426035619e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -1.260203437000000e+01 -4.037600000000197e-03 -2.389112426035619e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -1.260203444000000e+01 -4.037670000000659e-03 -2.389153846154237e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -1.259958891000000e+01 -1.592139999999631e-03 -9.420946745559948e-02 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -1.260203445000000e+01 -4.037679999999710e-03 -2.389159763313438e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -1.260203461000000e+01 -4.037840000000514e-03 -2.389254437870127e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -1.260203423000000e+01 -4.037459999999271e-03 -2.389029585798385e-01 PASS