Match comparison for Exchange energy (match type 3416)

Commits > Commit 3874475d54e6d4931162c1a62f5667add8f8f561 > Input 11-isotopes.01-deuterium.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.407176500000000e-01 3.000000000000000e-05 -2.407261421428571e-01 9.297171503199321e-07 -2.407245950000000e-01 1.805000000007495e-06 PASS

Checks for this match

  • MPI builders have different values.
  • GPU builders have different values.
    • Intel® builders have different values.
  • Mid point of values far away from reference. Recentering may be necessary.
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Detailed information

Reference: -0.24071765, precision: 0.00003
Run Value Difference Relative difference Status
foss_cmake: [foss2022a-serial, foss-min] -2.407264000000000e-01 -8.750000000001812e-06 -2.916666666667271e-01 PASS
foss_min_autotools: [foss2023b-serial] -2.407264000000000e-01 -8.750000000001812e-06 -2.916666666667271e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -2.407264000000000e-01 -8.750000000001812e-06 -2.916666666667271e-01 PASS
foss_min_autotools: [foss2023a-serial] -2.407264000000000e-01 -8.750000000001812e-06 -2.916666666667271e-01 PASS
foss_min_autotools: [foss2022a-serial] -2.407264000000000e-01 -8.750000000001812e-06 -2.916666666667271e-01 PASS
foss_autotools: [foss2023b-serial] -2.407264000000000e-01 -8.750000000001812e-06 -2.916666666667271e-01 PASS
foss_opt_autotools: [foss2023a-serial] -2.407264000000000e-01 -8.750000000001812e-06 -2.916666666667271e-01 PASS
foss_autotools: [foss2023a-serial] -2.407264000000000e-01 -8.750000000001812e-06 -2.916666666667271e-01 PASS
foss_debug_autotools: [foss2023a-serial] -2.407264000000000e-01 -8.750000000001812e-06 -2.916666666667271e-01 PASS
foss_autotools: [foss2022a-serial] -2.407264000000000e-01 -8.750000000001812e-06 -2.916666666667271e-01 PASS
intel_autotools: [intel2023a-serial] -2.407264000000000e-01 -8.750000000001812e-06 -2.916666666667271e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -2.407264000000000e-01 -8.750000000001812e-06 -2.916666666667271e-01 PASS
foss_mpi_min_autotools: [foss2023a-mpi] -2.407264000000000e-01 -8.750000000001812e-06 -2.916666666667271e-01 PASS
foss_mpi_min_autotools: [foss2022a-mpi] -2.407264000000000e-01 -8.750000000001812e-06 -2.916666666667271e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -2.407264000000000e-01 -8.750000000001812e-06 -2.916666666667271e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -2.407264000000000e-01 -8.750000000001812e-06 -2.916666666667271e-01 PASS
foss_omp_autotools: [foss2023a-serial] -2.407264000000000e-01 -8.750000000001812e-06 -2.916666666667271e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -2.407264000000000e-01 -8.750000000001812e-06 -2.916666666667271e-01 PASS
foss_mpi_autotools: [foss2022a-mpi] -2.407264000000000e-01 -8.750000000001812e-06 -2.916666666667271e-01 PASS
foss_mpi_autotools: [foss2023a-mpi] -2.407264000000000e-01 -8.750000000001812e-06 -2.916666666667271e-01 PASS
foss_ppc_autotools: [foss2022a-serial] -2.407264000000000e-01 -8.750000000001812e-06 -2.916666666667271e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -2.407264000000000e-01 -8.750000000001812e-06 -2.916666666667271e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -2.407227900000000e-01 -5.139999999986822e-06 -1.713333333328940e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -2.407264000000000e-01 -8.750000000001812e-06 -2.916666666667271e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -2.407264000000000e-01 -8.750000000001812e-06 -2.916666666667271e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -2.407227900000000e-01 -5.139999999986822e-06 -1.713333333328940e-01 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -2.407264000000000e-01 -8.750000000001812e-06 -2.916666666667271e-01 PASS
foss_valgrind_autotools: [foss2023a-serial] -2.407264000000000e-01 -8.750000000001812e-06 -2.916666666667271e-01 PASS