Match comparison for Total energy (match type 32210)

Commits > Commit 1d082993d3bad72c6bb5f6456239111dd26ba4bd > Input 01-nio.01-U5-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.657328987200000e+02 1.330000000000000e-07 -2.657328986777777e+02 7.067575944082331e-08 -2.657328987250000e+02 8.500001058564521e-08 PASS

Checks for this match

  • MPI builders have different values.
  • GPU builders have different values.
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Detailed information

Reference: -265.73289872, precision: 0.000000133
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -2.657328986400000e+02 8.000000661922968e-08 6.015038091671404e-01 PASS
intel_omp_autotools: [intel2023a-serial] -2.657328986400000e+02 8.000000661922968e-08 6.015038091671404e-01 PASS
foss-serial-full: [foss2023a-serial] -2.657328986400000e+02 8.000000661922968e-08 6.015038091671404e-01 PASS
foss-serial-min: [foss2023b-serial] -2.657328986400000e+02 8.000000661922968e-08 6.015038091671404e-01 PASS
foss-opt-full: [foss2023a-serial] -2.657328986400000e+02 8.000000661922968e-08 6.015038091671404e-01 PASS
foss-serial-min: [foss2022a-serial] -2.657328986400000e+02 8.000000661922968e-08 6.015038091671404e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -2.657328986400000e+02 8.000000661922968e-08 6.015038091671404e-01 PASS
cuda-mpi: [foss2022a-cuda-mpi] -2.657328988100000e+02 -9.000001455206075e-08 -6.766918387372988e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -2.657328988100000e+02 -9.000001455206075e-08 -6.766918387372988e-01 PASS