Match comparison for Total force (match type 23757)

Commits > Commit 6e9e1a4536d8fe2a292bd24d601ed608cb4be1e6 > Input 10-intersite.01-Na2.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.072994560000000e-16 3.980000000000000e-16 -8.526428721515152e-17 1.586231760704798e-16 -2.211772430000000e-16 3.443426100000000e-16 PASS

Checks for this match

  • Precision seems large and value close to zero. Should value be 0?
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Detailed information

Reference: -0.000000000000000207299456, precision: 0.000000000000000398
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-full] -3.920475060000000e-16 -1.847480500000000e-16 -4.641910804020100e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-min] -3.920475060000000e-16 -1.847480500000000e-16 -4.641910804020100e-01 PASS
foss-serial-min: [foss2022a-serial] -5.898059820000000e-17 1.483188578000000e-16 3.726604467336683e-01 PASS
foss-serial-min: [foss2023a-serial] -5.898059820000000e-17 1.483188578000000e-16 3.726604467336683e-01 PASS
intel_autotools: [intel2023a-serial] 9.020562080000001e-17 2.975050768000000e-16 7.475001929648242e-01 PASS
foss-opt-full: [foss2023a-serial] -9.714451469999999e-17 1.101549413000000e-16 2.767712092964824e-01 PASS
foss-serial-min: [foss2023b-serial] -5.898059820000000e-17 1.483188578000000e-16 3.726604467336683e-01 PASS
foss-serial-full: [foss2023a-serial] -5.898059820000000e-17 1.483188578000000e-16 3.726604467336683e-01 PASS
foss-serial-full: [foss2023b-serial] -5.898059820000000e-17 1.483188578000000e-16 3.726604467336683e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -3.833738880000000e-16 -1.760744320000000e-16 -4.423980703517588e-01 PASS
foss-ppc: [foss2022a-serial] 2.775557560000000e-17 2.350550316000000e-16 5.905905316582915e-01 PASS
intel_omp_autotools: [intel2022a-serial] 6.591949210000000e-17 2.732189481000000e-16 6.864797690954775e-01 PASS
intel_omp_autotools: [intel2023a-serial] 6.591949210000000e-17 2.732189481000000e-16 6.864797690954775e-01 PASS
foss-serial-debug: [foss2023a-serial] -5.898059820000000e-17 1.483188578000000e-16 3.726604467336683e-01 PASS
foss-omp-full: [foss2023a-serial] 0.000000000000000e+00 2.072994560000000e-16 5.208529045226130e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -3.833738880000000e-16 -1.760744320000000e-16 -4.423980703517588e-01 PASS
foss-mpi-full: [foss2023a-mpi] -1.058181320000000e-16 1.014813240000000e-16 2.549782010050251e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] 2.255140520000000e-17 2.298508612000000e-16 5.775147266331658e-01 PASS
foss-mpi-debug: [foss2023a-mpi] -1.058181320000000e-16 1.014813240000000e-16 2.549782010050251e-01 PASS
foss-mpi-min: [foss2023a-mpi] -1.058181320000000e-16 1.014813240000000e-16 2.549782010050251e-01 PASS
foss-mpi-min: [foss2022a-mpi] -1.058181320000000e-16 1.014813240000000e-16 2.549782010050251e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] -9.714451469999999e-17 1.101549413000000e-16 2.767712092964824e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -9.714451469999999e-17 1.101549413000000e-16 2.767712092964824e-01 PASS
foss-mpi-opt-full: [foss2023a-mpi] -4.163336340000000e-17 1.656660926000000e-16 4.162464638190955e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -4.163336340000000e-17 1.656660926000000e-16 4.162464638190955e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -4.163336340000000e-17 1.656660926000000e-16 4.162464638190955e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] 8.153200340000001e-17 2.888314594000000e-16 7.257071844221106e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -4.163336340000000e-17 1.656660926000000e-16 4.162464638190955e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -4.163336340000000e-17 1.656660926000000e-16 4.162464638190955e-01 PASS
foss-mpi-omp-full: [foss2023a-mpi] 2.602085210000000e-17 2.333203081000000e-16 5.862319298994976e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] 1.231653670000000e-16 3.304648230000000e-16 8.303136256281407e-01 PASS
valgrind: [foss2023a-serial] -5.655198530000000e-16 -3.582203969999999e-16 -9.000512487437184e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] 7.632783290000000e-17 2.836272889000000e-16 7.126313791457286e-01 PASS