Match comparison for Hartree energy (match type 29585)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -1.122754400000000e+01 | 5.610000000000000e-08 | -1.122754371461538e+01 | 1.005933285558336e-06 | -1.122754212000000e+01 | 1.890000000059899e-06 | FAIL |
Checks for this match
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Detailed information
Reference: -11.227544, precision: 0.0000000561| Run | Value | Difference | Relative difference | Status |
| intel-serial: [intel2023a-serial] | -1.122754401000000e+01 | -1.000000082740371e-08 | -1.782531341783193e-01 | PASS |
| foss-serial: [foss2023a-serial] | -1.122754401000000e+01 | -1.000000082740371e-08 | -1.782531341783193e-01 | PASS |
| foss-serial-debug: [foss2023a-serial] | -1.122754401000000e+01 | -1.000000082740371e-08 | -1.782531341783193e-01 | PASS |
| intel-min-parallel: [intel2022a-mpi] | -1.122754401000000e+01 | -1.000000082740371e-08 | -1.782531341783193e-01 | PASS |
| ppc: [foss2023a-serial] | -1.122754401000000e+01 | -1.000000082740371e-08 | -1.782531341783193e-01 | PASS |
| autotools_foss_mpi_omp: [foss2023a-mpi] | -1.122754400000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss-parallel-debug: [foss2023a-mpi] | -1.122754400000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| intel-parallel: [intel2023a-mpi] | -1.122754023000000e+01 | 3.769999999292395e-06 | 6.720142601234215e+01 | FAIL |
| foss-parallel: [foss2023a-mpi] | -1.122754400000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss-min-parallel: [foss2023b-mpi] | -1.122754400000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| autotools_intel_mpi_omp: [intel2023a-mpi] | -1.122754401000000e+01 | -1.000000082740371e-08 | -1.782531341783193e-01 | PASS |
| address-sanitizer: [foss2023a-serial, ci-foss-full] | -1.122754400000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss-min-parallel: [foss2022a-mpi] | -1.122754400000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |