Match comparison for Exchange energy (match type 23861)

Commits > Commit 995bec41f97239ed4859b75e5397558b96cd16ab > Input 25-Fe_polarized.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.308255894000000e+01 5.000000000000000e-07 -3.308255894153847e+01 9.134433105205177e-08 -3.308255896500000e+01 1.349999969590954e-07 PASS

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Detailed information

Reference: -33.08255894, precision: 0.0000005
Run Value Difference Relative difference Status
spack_foss-2022a_ppc -3.308255901000000e+01 -6.999999868639861e-08 -1.399999973727972e-01 PASS
cmake_foss_2022a_min_serial -3.308255883000000e+01 1.099999948905861e-07 2.199999897811722e-01 PASS
cmake_foss_2022a_full_serial -3.308255883000000e+01 1.099999948905861e-07 2.199999897811722e-01 PASS
cmake_foss_2022a_min_mpi -3.308255900000000e+01 -6.000000496442226e-08 -1.200000099288445e-01 PASS
cmake_foss_2022a_full_mpi -3.308255900000000e+01 -6.000000496442226e-08 -1.200000099288445e-01 PASS
spack_foss-2022a_mpi_min -3.308255900000000e+01 -6.000000496442226e-08 -1.200000099288445e-01 PASS
spack_foss-2022a_mpi -3.308255900000000e+01 -6.000000496442226e-08 -1.200000099288445e-01 PASS
spack_foss-2022a_serial -3.308255883000000e+01 1.099999948905861e-07 2.199999897811722e-01 PASS
spack_foss-2022a_cuda_mpi_omp -3.308255910000000e+01 -1.599999990276046e-07 -3.199999980552093e-01 PASS
spack_foss-2022a_serial_min -3.308255883000000e+01 1.099999948905861e-07 2.199999897811722e-01 PASS
spack_foss-2022a_cuda_serial -3.308255891000000e+01 2.999999537678377e-08 5.999999075356754e-02 PASS
spack_foss-2023a_mpi -3.308255900000000e+01 -6.000000496442226e-08 -1.200000099288445e-01 PASS
spack_foss-2023a_mpi_min -3.308255900000000e+01 -6.000000496442226e-08 -1.200000099288445e-01 PASS
spack_foss-2023a_serial -3.308255883000000e+01 1.099999948905861e-07 2.199999897811722e-01 PASS
spack_foss-2023a_serial_min -3.308255883000000e+01 1.099999948905861e-07 2.199999897811722e-01 PASS
spack_foss-2023a_mpi_opt -3.308255900000000e+01 -6.000000496442226e-08 -1.200000099288445e-01 PASS
spack_foss-2023a_serial_opt -3.308255883000000e+01 1.099999948905861e-07 2.199999897811722e-01 PASS
spack_foss-2023a_mpi_debug -3.308255900000000e+01 -6.000000496442226e-08 -1.200000099288445e-01 PASS
spack_foss-2023a_serial_debug -3.308255883000000e+01 1.099999948905861e-07 2.199999897811722e-01 PASS
spack_foss-2023b_serial -3.308255883000000e+01 1.099999948905861e-07 2.199999897811722e-01 PASS
spack_foss-2023a_serial_omp -3.308255907000000e+01 -1.300000036508209e-07 -2.600000073016417e-01 PASS
spack_intel-2022a_serial_omp -3.308255890000000e+01 3.999999620418748e-08 7.999999240837496e-02 PASS
spack_foss-2023a_mpi_omp -3.308255896000000e+01 -2.000000165480742e-08 -4.000000330961484e-02 PASS
spack_intel-2023a_serial -3.308255907000000e+01 -1.300000036508209e-07 -2.600000073016417e-01 PASS
spack_intel-2023a_impi -3.308255894000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2022a_impi_omp -3.308255905000000e+01 -1.100000019960135e-07 -2.200000039920269e-01 PASS