Match comparison for LDA Total Energy (match type 21063)
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
-4.179676910000000e+00 | 1.000000000000000e-04 | -4.179651569999999e+00 | 8.881784197001252e-16 | -4.179651570000000e+00 | 0.000000000000000e+00 | PASS |
Checks for this match
- Mid point of values far away from reference. Recentering may be necessary.
Loading plot...
Detailed information
Reference: -4.17967691, precision: 0.0001Run | Value | Difference | Relative difference | Status |
intel-serial: [intel2023a-serial] | -4.179651570000000e+00 | 2.534000000053993e-05 | 2.534000000053993e-01 | PASS |
foss-serial: [foss2023a-serial] | -4.179651570000000e+00 | 2.534000000053993e-05 | 2.534000000053993e-01 | PASS |
foss-serial-debug: [foss2023a-serial] | -4.179651570000000e+00 | 2.534000000053993e-05 | 2.534000000053993e-01 | PASS |
intel-min-parallel: [intel2022a-mpi] | -4.179651570000000e+00 | 2.534000000053993e-05 | 2.534000000053993e-01 | PASS |
ppc: [foss2023a-serial] | -4.179651570000000e+00 | 2.534000000053993e-05 | 2.534000000053993e-01 | PASS |
autotools_foss_mpi_omp: [foss2023a-mpi] | -4.179651570000000e+00 | 2.534000000053993e-05 | 2.534000000053993e-01 | PASS |
foss-parallel-debug: [foss2023a-mpi] | -4.179651570000000e+00 | 2.534000000053993e-05 | 2.534000000053993e-01 | PASS |
intel-parallel: [intel2023a-mpi] | -4.179651570000000e+00 | 2.534000000053993e-05 | 2.534000000053993e-01 | PASS |
foss-parallel: [foss2023a-mpi] | -4.179651570000000e+00 | 2.534000000053993e-05 | 2.534000000053993e-01 | PASS |
foss-min-parallel: [foss2023b-mpi] | -4.179651570000000e+00 | 2.534000000053993e-05 | 2.534000000053993e-01 | PASS |
autotools_intel_mpi_omp: [intel2023a-mpi] | -4.179651570000000e+00 | 2.534000000053993e-05 | 2.534000000053993e-01 | PASS |
address-sanitizer: [foss2023a-serial, ci-foss-full] | -4.179651570000000e+00 | 2.534000000053993e-05 | 2.534000000053993e-01 | PASS |
foss-min-parallel: [foss2022a-mpi] | -4.179651570000000e+00 | 2.534000000053993e-05 | 2.534000000053993e-01 | PASS |
cuda: [foss2022a-cuda-mpi, ci-foss-full-cuda] | -4.179651570000000e+00 | 2.534000000053993e-05 | 2.534000000053993e-01 | PASS |
cuda: [foss2022a-cuda-mpi, ci-foss-full-mpi-omp-cuda] | -4.179651570000000e+00 | 2.534000000053993e-05 | 2.534000000053993e-01 | PASS |