Match comparison for Kinetic energy (match type 3523)

Commits > Commit f1dbe11076ccb3bb542605fe66566061d8720041 > Input 15-calcium_psp8_sic.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
4.918431900000000e-01 3.000000000000000e-07 4.918431092857142e-01 2.575393766832992e-09 4.918431049999999e-01 4.999999997368221e-09 PASS

Checks for this match

  • 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: 0.49184319, precision: 0.0000003
Run Value Difference Relative difference Status
spack_foss-2022a_ppc 4.918431100000000e-01 -8.000000001340268e-08 -2.666666667113423e-01 PASS
cmake_foss_2022a_full_serial 4.918431100000000e-01 -8.000000001340268e-08 -2.666666667113423e-01 PASS
cmake_foss_2022a_min_serial 4.918431100000000e-01 -8.000000001340268e-08 -2.666666667113423e-01 PASS
spack_foss-2022a_cuda_mpi_omp 4.918431000000000e-01 -9.000000000813912e-08 -3.000000000271305e-01 PASS
cmake_foss_2022a_min_mpi 4.918431100000000e-01 -8.000000001340268e-08 -2.666666667113423e-01 PASS
cmake_foss_2022a_full_mpi 4.918431100000000e-01 -8.000000001340268e-08 -2.666666667113423e-01 PASS
spack_foss-2022a_serial_min 4.918431100000000e-01 -8.000000001340268e-08 -2.666666667113423e-01 PASS
spack_foss-2022a_serial 4.918431100000000e-01 -8.000000001340268e-08 -2.666666667113423e-01 PASS
spack_foss-2022a_mpi_min 4.918431100000000e-01 -8.000000001340268e-08 -2.666666667113423e-01 PASS
spack_foss-2022a_mpi 4.918431100000000e-01 -8.000000001340268e-08 -2.666666667113423e-01 PASS
spack_foss-2023a_mpi 4.918431100000000e-01 -8.000000001340268e-08 -2.666666667113423e-01 PASS
spack_foss-2023a_mpi_min 4.918431100000000e-01 -8.000000001340268e-08 -2.666666667113423e-01 PASS
spack_foss-2023a_mpi_debug 4.918431100000000e-01 -8.000000001340268e-08 -2.666666667113423e-01 PASS
spack_foss-2023a_serial 4.918431100000000e-01 -8.000000001340268e-08 -2.666666667113423e-01 PASS
spack_foss-2023a_serial_min 4.918431100000000e-01 -8.000000001340268e-08 -2.666666667113423e-01 PASS
spack_foss-2022a_cuda_serial 4.918431000000000e-01 -9.000000000813912e-08 -3.000000000271305e-01 PASS
spack_foss-2023a_mpi_opt 4.918431100000000e-01 -8.000000001340268e-08 -2.666666667113423e-01 PASS
spack_foss-2023a_serial_debug 4.918431100000000e-01 -8.000000001340268e-08 -2.666666667113423e-01 PASS
spack_foss-2023a_serial_opt 4.918431100000000e-01 -8.000000001340268e-08 -2.666666667113423e-01 PASS
spack_foss-2023b_serial 4.918431100000000e-01 -8.000000001340268e-08 -2.666666667113423e-01 PASS
spack_foss-2023a_serial_omp 4.918431100000000e-01 -8.000000001340268e-08 -2.666666667113423e-01 PASS
spack_foss-2023a_mpi_omp 4.918431100000000e-01 -8.000000001340268e-08 -2.666666667113423e-01 PASS
spack_intel-2023a_serial 4.918431100000000e-01 -8.000000001340268e-08 -2.666666667113423e-01 PASS
spack_intel-2022a_serial_omp 4.918431100000000e-01 -8.000000001340268e-08 -2.666666667113423e-01 PASS
spack_intel-2023a_serial_omp 4.918431100000000e-01 -8.000000001340268e-08 -2.666666667113423e-01 PASS
spack_intel-2023a_impi 4.918431100000000e-01 -8.000000001340268e-08 -2.666666667113423e-01 PASS
spack_intel-2022a_impi_omp 4.918431100000000e-01 -8.000000001340268e-08 -2.666666667113423e-01 PASS
spack_foss-2023a_valgrind 4.918431100000000e-01 -8.000000001340268e-08 -2.666666667113423e-01 PASS