Match comparison for Total energy (match type 26601)

Commits > Commit 7a2cd2a0801cf0c9aaf759ff5aac90b0fe91b5f6 > Input 28-mgga_kli.01-Si_scan.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-7.948215400000000e+00 3.970000000000000e-07 -7.948215355769231e+00 4.940474038691804e-09 -7.948215355000000e+00 4.999999969612645e-09 PASS

Checks for this match

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

Reference: -7.9482154, precision: 0.000000397
Run Value Difference Relative difference Status
spack_foss-2022a_serial_min -7.948215360000000e+00 3.999999975690116e-08 1.007556668939576e-01 PASS
cmake_foss_2022a_full_serial -7.948215360000000e+00 3.999999975690116e-08 1.007556668939576e-01 PASS
spack_foss-2022a_serial -7.948215360000000e+00 3.999999975690116e-08 1.007556668939576e-01 PASS
spack_foss-2022a_ppc -7.948215360000000e+00 3.999999975690116e-08 1.007556668939576e-01 PASS
spack_foss-2023a_mpi_min -7.948215350000000e+00 4.999999969612645e-08 1.259445836174470e-01 PASS
cmake_foss_2022a_min_serial -7.948215360000000e+00 3.999999975690116e-08 1.007556668939576e-01 PASS
spack_foss-2022a_mpi_min -7.948215350000000e+00 4.999999969612645e-08 1.259445836174470e-01 PASS
spack_foss-2023a_mpi -7.948215350000000e+00 4.999999969612645e-08 1.259445836174470e-01 PASS
cmake_foss_2022a_full_mpi -7.948215350000000e+00 4.999999969612645e-08 1.259445836174470e-01 PASS
spack_foss-2022a_mpi -7.948215350000000e+00 4.999999969612645e-08 1.259445836174470e-01 PASS
cmake_foss_2022a_min_mpi -7.948215350000000e+00 4.999999969612645e-08 1.259445836174470e-01 PASS
spack_foss-2023a_mpi_debug -7.948215350000000e+00 4.999999969612645e-08 1.259445836174470e-01 PASS
spack_foss-2023a_serial -7.948215360000000e+00 3.999999975690116e-08 1.007556668939576e-01 PASS
spack_foss-2023a_mpi_opt -7.948215350000000e+00 4.999999969612645e-08 1.259445836174470e-01 PASS
spack_foss-2022a_cuda_serial -7.948215360000000e+00 3.999999975690116e-08 1.007556668939576e-01 PASS
spack_foss-2023a_serial_debug -7.948215360000000e+00 3.999999975690116e-08 1.007556668939576e-01 PASS
spack_foss-2023a_serial_min -7.948215360000000e+00 3.999999975690116e-08 1.007556668939576e-01 PASS
spack_foss-2023a_serial_opt -7.948215360000000e+00 3.999999975690116e-08 1.007556668939576e-01 PASS
spack_foss-2023a_mpi_omp -7.948215350000000e+00 4.999999969612645e-08 1.259445836174470e-01 PASS
spack_foss-2023b_serial -7.948215360000000e+00 3.999999975690116e-08 1.007556668939576e-01 PASS
spack_foss-2023a_serial_omp -7.948215360000000e+00 3.999999975690116e-08 1.007556668939576e-01 PASS
spack_intel-2023a_serial -7.948215360000000e+00 3.999999975690116e-08 1.007556668939576e-01 PASS
spack_intel-2022a_serial_omp -7.948215360000000e+00 3.999999975690116e-08 1.007556668939576e-01 PASS
spack_intel-2023a_serial_omp -7.948215360000000e+00 3.999999975690116e-08 1.007556668939576e-01 PASS
spack_intel-2023a_impi -7.948215350000000e+00 4.999999969612645e-08 1.259445836174470e-01 PASS
spack_intel-2022a_impi_omp -7.948215350000000e+00 4.999999969612645e-08 1.259445836174470e-01 PASS