Match comparison for Exchange energy (match type 21130)
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
-1.259799677000000e+01 | 2.050000000000000e-02 | -1.260134138210526e+01 | 2.002338199281061e-03 | -1.259770149500000e+01 | 4.333014999999385e-03 | PASS |
Checks for this match
- GPU builders have different values.
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Detailed information
Reference: -12.59799677, precision: 0.0205Run | Value | Difference | Relative difference | Status |
foss-serial-zen4: [foss2023a-serial] | -1.260203451000000e+01 | -4.037739999999346e-03 | -1.969629268292364e-01 | PASS |
intel-serial: [intel2023a-serial] | -1.260203419000000e+01 | -4.037419999999514e-03 | -1.969473170731470e-01 | PASS |
foss-serial-debug: [foss2023a-serial] | -1.260203439000000e+01 | -4.037620000000075e-03 | -1.969570731707354e-01 | PASS |
intel-min-parallel: [intel2022a-mpi] | -1.260203437000000e+01 | -4.037600000000197e-03 | -1.969560975609852e-01 | PASS |
intel-parallel: [intel2023a-mpi] | -1.260203437000000e+01 | -4.037600000000197e-03 | -1.969560975609852e-01 | PASS |
foss-parallel-zen4: [foss2023a-mpi] | -1.260203446000000e+01 | -4.037690000000538e-03 | -1.969604878049043e-01 | PASS |
foss-min-parallel-zen4: [foss2023a-mpi] | -1.260203432000000e+01 | -4.037549999999612e-03 | -1.969536585365664e-01 | PASS |
autotools_foss_mpi_omp: [foss2023a-mpi] | -1.260203434000000e+01 | -4.037569999999491e-03 | -1.969546341463166e-01 | PASS |
foss-serial: [foss2023a-serial] | -1.260203439000000e+01 | -4.037620000000075e-03 | -1.969570731707354e-01 | PASS |
foss-parallel-debug: [foss2023a-mpi] | -1.260203434000000e+01 | -4.037569999999491e-03 | -1.969546341463166e-01 | PASS |
ppc: [foss2023a-serial] | -1.260203441000000e+01 | -4.037639999999953e-03 | -1.969580487804855e-01 | PASS |
cuda: [foss2022a-cuda-mpi, ci-foss-full-cuda] | -1.259336848000000e+01 | 4.628289999999424e-03 | 2.257702439024109e-01 | PASS |
autotools_intel_mpi_omp: [intel2023a-mpi] | -1.260203442000000e+01 | -4.037650000000781e-03 | -1.969585365854039e-01 | PASS |
intel-serial-debug: [intel2023a-serial] | -1.260203419000000e+01 | -4.037419999999514e-03 | -1.969473170731470e-01 | PASS |
foss-parallel: [foss2023a-mpi] | -1.260203434000000e+01 | -4.037569999999491e-03 | -1.969546341463166e-01 | PASS |
foss-min-parallel: [foss2023b-mpi] | -1.260203438000000e+01 | -4.037609999999248e-03 | -1.969565853658169e-01 | PASS |
intel-parallel-debug: [intel2023a-mpi] | -1.260203437000000e+01 | -4.037600000000197e-03 | -1.969560975609852e-01 | PASS |
cuda: [foss2022a-cuda-mpi, ci-foss-full-mpi-omp-cuda] | -1.259958881000000e+01 | -1.592040000000239e-03 | -7.766048780488970e-02 | PASS |
foss-min-parallel: [foss2022a-mpi] | -1.259997918000000e+01 | -1.982410000000101e-03 | -9.670292682927321e-02 | PASS |