Match comparison for Exchange energy (match type 23861)

Commits > Commit dd0acda4415b0ab64c529ca4a26922f9782edb94 > Input 25-Fe_polarized.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.308255894000000e+01 5.000000000000000e-07 -3.308255889481481e+01 1.273190901243658e-07 -3.308255891500000e+01 1.949999983708040e-07 PASS
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Detailed information

Reference: -33.08255894, precision: 0.0000005
Run Value Difference Relative difference Status
cmake_foss_2022a_full_serial -3.308255893000000e+01 1.000000082740371e-08 2.000000165480742e-02 PASS
spack_foss-2022a_ppc -3.308255911000000e+01 -1.699999998550084e-07 -3.399999997100167e-01 PASS
cmake_foss_2022a_min_serial -3.308255893000000e+01 1.000000082740371e-08 2.000000165480742e-02 PASS
cmake_foss_2022a_min_mpi -3.308255872000000e+01 2.199999968865995e-07 4.399999937731991e-01 PASS
cmake_foss_2022a_full_mpi -3.308255872000000e+01 2.199999968865995e-07 4.399999937731991e-01 PASS
spack_foss-2022a_mpi_min -3.308255872000000e+01 2.199999968865995e-07 4.399999937731991e-01 PASS
spack_foss-2022a_mpi -3.308255872000000e+01 2.199999968865995e-07 4.399999937731991e-01 PASS
spack_foss-2022a_serial -3.308255893000000e+01 1.000000082740371e-08 2.000000165480742e-02 PASS
spack_foss-2022a_serial_min -3.308255893000000e+01 1.000000082740371e-08 2.000000165480742e-02 PASS
spack_foss-2023a_mpi -3.308255872000000e+01 2.199999968865995e-07 4.399999937731991e-01 PASS
spack_foss-2023a_mpi_min -3.308255872000000e+01 2.199999968865995e-07 4.399999937731991e-01 PASS
spack_foss-2023a_serial_min -3.308255893000000e+01 1.000000082740371e-08 2.000000165480742e-02 PASS
spack_foss-2023a_serial -3.308255893000000e+01 1.000000082740371e-08 2.000000165480742e-02 PASS
spack_foss-2023a_mpi_opt -3.308255872000000e+01 2.199999968865995e-07 4.399999937731991e-01 PASS
spack_foss-2023a_mpi_debug -3.308255872000000e+01 2.199999968865995e-07 4.399999937731991e-01 PASS
spack_foss-2023a_serial_opt -3.308255893000000e+01 1.000000082740371e-08 2.000000165480742e-02 PASS
spack_foss-2023b_serial -3.308255893000000e+01 1.000000082740371e-08 2.000000165480742e-02 PASS
spack_foss-2023a_serial_debug -3.308255893000000e+01 1.000000082740371e-08 2.000000165480742e-02 PASS
spack_foss-2023a_serial_omp -3.308255896000000e+01 -2.000000165480742e-08 -4.000000330961484e-02 PASS
spack_intel-2022a_serial_omp -3.308255902000000e+01 -7.999999951380232e-08 -1.599999990276046e-01 PASS
spack_foss-2023a_mpi_omp -3.308255907000000e+01 -1.300000036508209e-07 -2.600000073016417e-01 PASS
spack_intel-2023a_serial -3.308255908000000e+01 -1.400000044782246e-07 -2.800000089564492e-01 PASS
spack_intel-2023a_impi -3.308255902000000e+01 -7.999999951380232e-08 -1.599999990276046e-01 PASS
spack_foss-2022a_cuda_mpi_omp -3.308255900000000e+01 -6.000000496442226e-08 -1.200000099288445e-01 PASS
spack_intel-2023a_serial_omp -3.308255889000000e+01 4.999999703159119e-08 9.999999406318238e-02 PASS
spack_intel-2022a_impi_omp -3.308255884000000e+01 1.000000011686097e-07 2.000000023372195e-01 PASS
spack_foss-2022a_cuda_serial -3.308255904000000e+01 -1.000000011686097e-07 -2.000000023372195e-01 PASS