Match comparison for RDMFT converged energy (match type 11923)
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
-1.150582391700000e+00 | 1.000000000000000e-03 | -1.150813245144000e+00 | 2.159891880603401e-05 | -1.150779814900000e+00 | 3.981749999992790e-05 | PASS |
Checks for this match
- GPU builders have different values.
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: -1.1505823917, precision: 0.001Run | Value | Difference | Relative difference | Status |
foss-2022a_ppc | -1.150819607900000e+00 | -2.372161999999456e-04 | -2.372161999999456e-01 | PASS |
eb_fosscuda-2022a | -1.150740001900000e+00 | -1.576102000000468e-04 | -1.576102000000468e-01 | PASS |
cmake_foss_2022a_full_serial | -1.150819606200000e+00 | -2.372145000000270e-04 | -2.372145000000270e-01 | PASS |
cmake_foss_2022a_full_mpi | -1.150819615800000e+00 | -2.372240999999331e-04 | -2.372240999999331e-01 | PASS |
cmake_foss_2022a_min_serial | -1.150819606200000e+00 | -2.372145000000270e-04 | -2.372145000000270e-01 | PASS |
cmake_foss_2022a_min_mpi | -1.150819617900000e+00 | -2.372262000001069e-04 | -2.372262000001069e-01 | PASS |
eb_foss-2022a | -1.150819605600000e+00 | -2.372138999999773e-04 | -2.372138999999773e-01 | PASS |
eb_foss-2022a_debug | -1.150819605600000e+00 | -2.372138999999773e-04 | -2.372138999999773e-01 | PASS |
eb_foss-2022b_libxc6 | -1.150819606600000e+00 | -2.372149000000601e-04 | -2.372149000000601e-01 | PASS |
foss-2022a_opt | -1.150819632400000e+00 | -2.372406999999743e-04 | -2.372406999999743e-01 | PASS |
eb_foss-2022a_mpi | -1.150819610900000e+00 | -2.372191999999718e-04 | -2.372191999999718e-01 | PASS |
foss-2022a_omp | -1.150819618700000e+00 | -2.372269999999510e-04 | -2.372269999999510e-01 | PASS |
eb_foss-2022b_libxc6_mpi | -1.150819622400000e+00 | -2.372307000000351e-04 | -2.372307000000351e-01 | PASS |
intel-2022a | -1.150819616300000e+00 | -2.372245999999745e-04 | -2.372245999999745e-01 | PASS |
foss-2022a_mpi_omp | -1.150819624500000e+00 | -2.372327999999868e-04 | -2.372327999999868e-01 | PASS |
eb_foss-2022a_mpi_debug | -1.150819610900000e+00 | -2.372191999999718e-04 | -2.372191999999718e-01 | PASS |
intel-2022b | -1.150819616300000e+00 | -2.372245999999745e-04 | -2.372245999999745e-01 | PASS |
intel-2022a_omp | -1.150819606700000e+00 | -2.372150000000683e-04 | -2.372150000000683e-01 | PASS |
eb_fosscuda-2022a_mpi_omp | -1.150739997400000e+00 | -1.576057000001185e-04 | -1.576057000001185e-01 | PASS |
spack_foss-2022a_serial | -1.150819617800000e+00 | -2.372261000000986e-04 | -2.372261000000986e-01 | PASS |
intel-2022a_impi | -1.150819613900000e+00 | -2.372221999999979e-04 | -2.372221999999979e-01 | PASS |
spack_foss-2022a_serial_min | -1.150819617800000e+00 | -2.372261000000986e-04 | -2.372261000000986e-01 | PASS |
spack_foss-2022a_serial_omp | -1.150819615000000e+00 | -2.372233000000890e-04 | -2.372233000000890e-01 | PASS |
spack_foss-2022a_serial_debug | -1.150819617800000e+00 | -2.372261000000986e-04 | -2.372261000000986e-01 | PASS |
intel-2022a_omp_impi | -1.150819616100000e+00 | -2.372243999999579e-04 | -2.372243999999579e-01 | PASS |