Match comparison for Hartree energy (match type 26101)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 4.244572722000000e+01 | 2.880000000000000e-06 | 4.244572608187499e+01 | 4.222738854815517e-07 | 4.244572617000000e+01 | 5.999999999062311e-07 | PASS |
Checks for this match
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Detailed information
Reference: 42.44572722, precision: 0.00000288| Run | Value | Difference | Relative difference | Status |
| spack_foss-2022a_serial_min | 4.244572557000000e+01 | -1.650000001518492e-06 | -5.729166671939210e-01 | PASS |
| spack_foss-2023a_serial_min | 4.244572557000000e+01 | -1.650000001518492e-06 | -5.729166671939210e-01 | PASS |
| spack_foss-2022a_serial_opt | 4.244572557000000e+01 | -1.650000001518492e-06 | -5.729166671939210e-01 | PASS |
| spack_foss-2022a_serial | 4.244572557000000e+01 | -1.650000001518492e-06 | -5.729166671939210e-01 | PASS |
| spack_foss-2022a_ppc | 4.244572598000000e+01 | -1.240000003122077e-06 | -4.305555566396101e-01 | PASS |
| spack_foss-2022a_mpi_min | 4.244572642000000e+01 | -8.000000022434506e-07 | -2.777777785567537e-01 | PASS |
| spack_foss-2023a_mpi_min | 4.244572642000000e+01 | -8.000000022434506e-07 | -2.777777785567537e-01 | PASS |
| spack_foss-2022a_mpi_opt | 4.244572642000000e+01 | -8.000000022434506e-07 | -2.777777785567537e-01 | PASS |
| spack_foss-2022a_serial_debug | 4.244572557000000e+01 | -1.650000001518492e-06 | -5.729166671939210e-01 | PASS |
| spack_intel-2022a_serial_omp | 4.244572586000000e+01 | -1.359999998840067e-06 | -4.722222218194677e-01 | PASS |
| spack_foss-2022a_mpi | 4.244572642000000e+01 | -8.000000022434506e-07 | -2.777777785567537e-01 | PASS |
| spack_intel-2023a_impi | 4.244572578000000e+01 | -1.440000005459297e-06 | -5.000000018955891e-01 | PASS |
| spack_foss-2022a_mpi_debug | 4.244572642000000e+01 | -8.000000022434506e-07 | -2.777777785567537e-01 | PASS |
| spack_foss-2022a_cuda_serial | 4.244572659000000e+01 | -6.300000023884422e-07 | -2.187500008293202e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | 4.244572638000000e+01 | -8.399999984476381e-07 | -2.916666661276521e-01 | PASS |
| spack_intel-2022a_impi_omp | 4.244572677000000e+01 | -4.500000017060302e-07 | -1.562500005923716e-01 | PASS |