Match comparison for Exchange energy (match type 27133)

Commits > Commit babc485c55a2119a415aa56305cb49f398154cb7 > Input 02-ACBN0.01-nio.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.401705334000000e+01 2.400000000000000e-06 -3.401705330473684e+01 1.969602790545821e-07 -3.401705327499999e+01 5.049999991513232e-07 PASS
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Detailed information

Reference: -34.01705334, precision: 0.0000024
Run Value Difference Relative difference Status
spack_foss-2022a_ppc -3.401705307000000e+01 2.699999939181907e-07 1.124999974659128e-01 PASS
spack_foss-2022a_cuda_serial -3.401705378000000e+01 -4.400000008786265e-07 -1.833333336994277e-01 PASS
spack_foss-2022a_serial -3.401705328000000e+01 5.999999785899490e-08 2.499999910791454e-02 PASS
spack_foss-2022a_mpi -3.401705330000000e+01 3.999999620418748e-08 1.666666508507812e-02 PASS
spack_foss-2022a_serial_min -3.401705328000000e+01 5.999999785899490e-08 2.499999910791454e-02 PASS
spack_foss-2022a_mpi_min -3.401705330000000e+01 3.999999620418748e-08 1.666666508507812e-02 PASS
spack_foss-2022a_mpi_opt -3.401705330000000e+01 3.999999620418748e-08 1.666666508507812e-02 PASS
spack_foss-2022a_serial_opt -3.401705328000000e+01 5.999999785899490e-08 2.499999910791454e-02 PASS
spack_foss-2022a_serial_debug -3.401705328000000e+01 5.999999785899490e-08 2.499999910791454e-02 PASS
spack_foss-2023a_serial -3.401705329000000e+01 4.999999703159119e-08 2.083333209649633e-02 PASS
spack_foss-2022a_cuda_mpi_omp -3.401705346000000e+01 -1.200000028234172e-07 -5.000000117642382e-02 PASS
spack_foss-2023a_serial_omp -3.401705328000000e+01 5.999999785899490e-08 2.499999910791454e-02 PASS
spack_foss-2022a_mpi_debug -3.401705330000000e+01 3.999999620418748e-08 1.666666508507812e-02 PASS
spack_foss-2023a_serial_min -3.401705329000000e+01 4.999999703159119e-08 2.083333209649633e-02 PASS
spack_intel-2022a_serial_omp -3.401705327000000e+01 6.999999868639861e-08 2.916666611933276e-02 PASS
spack_intel-2023a_serial -3.401705329000000e+01 4.999999703159119e-08 2.083333209649633e-02 PASS
spack_intel-2023a_serial_omp -3.401705277000000e+01 5.699999974240200e-07 2.374999989266750e-01 PASS
spack_intel-2023a_impi -3.401705329000000e+01 4.999999703159119e-08 2.083333209649633e-02 PASS
spack_intel-2022a_impi_omp -3.401705368000000e+01 -3.399999997100167e-07 -1.416666665458403e-01 PASS