Match comparison for Hartree energy (match type 22774)
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
3.146017431000000e+01 | 1.570000000000000e-07 | 3.146017431000000e+01 | 3.552713678800501e-15 | 3.146017431000000e+01 | 0.000000000000000e+00 | PASS |
Checks do not indicate problems with this match.
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Detailed information
Reference: 31.46017431, precision: 0.000000157Run | Value | Difference | Relative difference | Status |
spack_foss-2023a_serial_min | 3.146017431000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
spack_foss-2022a_serial_min | 3.146017431000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
spack_foss-2022a_serial | 3.146017431000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
spack_foss-2022a_serial_opt | 3.146017431000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
spack_foss-2022a_ppc | 3.146017431000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
spack_foss-2022a_mpi_min | 3.146017431000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
spack_foss-2023a_mpi_min | 3.146017431000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
spack_foss-2022a_serial_debug | 3.146017431000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
spack_foss-2022a_mpi_opt | 3.146017431000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
spack_intel-2022a_serial_omp | 3.146017431000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
spack_foss-2022a_mpi | 3.146017431000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
spack_foss-2022a_cuda_serial | 3.146017431000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
spack_intel-2023a_impi | 3.146017431000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
spack_foss-2022a_mpi_debug | 3.146017431000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
spack_foss-2022a_cuda_mpi_omp | 3.146017431000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
spack_intel-2022a_impi_omp | 3.146017431000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
spack_foss-2022a_valgrind | 3.146017431000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |