Match comparison for Exchange energy (match type 26859)

Commits > Commit c9606f298ccf4e57d14167459d26815f7508aa3e > Input 10-vdw_d3_dna.02-gs_d3.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-7.459613582999999e+01 5.770000000000000e-07 -7.459613543799999e+01 1.708293481476634e-07 -7.459613582000000e+01 5.299999941144051e-07 PASS

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Detailed information

Reference: -74.59613583, precision: 0.000000577
Run Value Difference Relative difference Status
foss_cmake: [foss2022a-serial, foss-min] -7.459613541000000e+01 4.199999921183917e-07 7.279029326141969e-01 PASS
foss_min_autotools: [foss2023a-serial] -7.459613541000000e+01 4.199999921183917e-07 7.279029326141969e-01 PASS
foss_min_autotools: [foss2022a-serial] -7.459613541000000e+01 4.199999921183917e-07 7.279029326141969e-01 PASS
intel_autotools: [intel2023a-serial] -7.459613634999999e+01 -5.200000003924288e-07 -9.012131722572422e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -7.459613541000000e+01 4.199999921183917e-07 7.279029326141969e-01 PASS
foss_min_autotools: [foss2023b-serial] -7.459613541000000e+01 4.199999921183917e-07 7.279029326141969e-01 PASS
foss_autotools: [foss2023a-serial] -7.459613541000000e+01 4.199999921183917e-07 7.279029326141969e-01 PASS
foss_opt_autotools: [foss2023a-serial] -7.459613541000000e+01 4.199999921183917e-07 7.279029326141969e-01 PASS
foss_autotools: [foss2023b-serial] -7.459613541000000e+01 4.199999921183917e-07 7.279029326141969e-01 PASS
foss_autotools: [foss2022a-serial] -7.459613541000000e+01 4.199999921183917e-07 7.279029326141969e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -7.459613541000000e+01 4.199999921183917e-07 7.279029326141969e-01 PASS
foss_mpi_min_autotools: [foss2023a-mpi] -7.459613541000000e+01 4.199999921183917e-07 7.279029326141969e-01 PASS
foss_mpi_min_autotools: [foss2022a-mpi] -7.459613541000000e+01 4.199999921183917e-07 7.279029326141969e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -7.459613541000000e+01 4.199999921183917e-07 7.279029326141969e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -7.459613541000000e+01 4.199999921183917e-07 7.279029326141969e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -7.459613541000000e+01 4.199999921183917e-07 7.279029326141969e-01 PASS
foss_debug_autotools: [foss2023a-serial] -7.459613541000000e+01 4.199999921183917e-07 7.279029326141969e-01 PASS
foss_omp_autotools: [foss2023a-serial] -7.459613541000000e+01 4.199999921183917e-07 7.279029326141969e-01 PASS
intel_omp_autotools: [intel2022a-serial] -7.459613541000000e+01 4.199999921183917e-07 7.279029326141969e-01 PASS
foss_mpi_autotools: [foss2023a-mpi] -7.459613541000000e+01 4.199999921183917e-07 7.279029326141969e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -7.459613541000000e+01 4.199999921183917e-07 7.279029326141969e-01 PASS
intel_omp_autotools: [intel2023a-serial] -7.459613541000000e+01 4.199999921183917e-07 7.279029326141969e-01 PASS
foss_ppc_autotools: [foss2022a-serial] -7.459613544000000e+01 3.899999967416079e-07 6.759098730357156e-01 PASS
foss_mpi_autotools: [foss2022a-mpi] -7.459613541000000e+01 4.199999921183917e-07 7.279029326141969e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -7.459613541000000e+01 4.199999921183917e-07 7.279029326141969e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -7.459613541000000e+01 4.199999921183917e-07 7.279029326141969e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -7.459613529000001e+01 5.399999878363815e-07 9.358751955569868e-01 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -7.459613541000000e+01 4.199999921183917e-07 7.279029326141969e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -7.459613539999999e+01 4.300000000512227e-07 7.452339688929336e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -7.459613541000000e+01 4.199999921183917e-07 7.279029326141969e-01 PASS