Match comparison for RDMFT converged energy (match type 11926)
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
-1.175869933000000e+00 | 1.000000000000000e-03 | -1.176089729560870e+00 | 8.333275468067131e-06 | -1.176101939450000e+00 | 1.479385000002775e-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: -1.175869933, precision: 0.001Run | Value | Difference | Relative difference | Status |
spack_foss-2022a_serial_min | -1.176087168700000e+00 | -2.172357000000957e-04 | -2.172357000000957e-01 | PASS |
spack_foss-2023a_serial_min | -1.176087168700000e+00 | -2.172357000000957e-04 | -2.172357000000957e-01 | PASS |
spack_foss-2023a_serial | -1.176087168700000e+00 | -2.172357000000957e-04 | -2.172357000000957e-01 | PASS |
spack_foss-2022a_serial | -1.176087168700000e+00 | -2.172357000000957e-04 | -2.172357000000957e-01 | PASS |
spack_foss-2023a_serial_opt | -1.176087149300000e+00 | -2.172163000000449e-04 | -2.172163000000449e-01 | PASS |
spack_foss-2023b_serial | -1.176087168700000e+00 | -2.172357000000957e-04 | -2.172357000000957e-01 | PASS |
spack_foss-2022a_ppc | -1.176087154500000e+00 | -2.172215000000310e-04 | -2.172215000000310e-01 | PASS |
spack_foss-2022a_mpi_min | -1.176087155200000e+00 | -2.172222000000890e-04 | -2.172222000000890e-01 | PASS |
spack_foss-2023a_mpi_min | -1.176087155200000e+00 | -2.172222000000890e-04 | -2.172222000000890e-01 | PASS |
spack_foss-2023a_serial_omp | -1.176087152200000e+00 | -2.172192000000628e-04 | -2.172192000000628e-01 | PASS |
spack_foss-2023a_serial_debug | -1.176087168700000e+00 | -2.172357000000957e-04 | -2.172357000000957e-01 | PASS |
spack_foss-2023a_mpi_opt | -1.176087153500000e+00 | -2.172204999999483e-04 | -2.172204999999483e-01 | PASS |
spack_foss-2022a_mpi | -1.176087155200000e+00 | -2.172222000000890e-04 | -2.172222000000890e-01 | PASS |
spack_foss-2023a_mpi | -1.176087155200000e+00 | -2.172222000000890e-04 | -2.172222000000890e-01 | PASS |
spack_foss-2022a_cuda_serial | -1.176116731600000e+00 | -2.467986000000977e-04 | -2.467986000000977e-01 | PASS |
spack_foss-2023a_mpi_debug | -1.176087155200000e+00 | -2.172222000000890e-04 | -2.172222000000890e-01 | PASS |
spack_foss-2023a_mpi_omp | -1.176087154300000e+00 | -2.172213000000145e-04 | -2.172213000000145e-01 | PASS |
spack_foss-2022a_cuda_mpi_omp | -1.176116733300000e+00 | -2.468003000000163e-04 | -2.468003000000163e-01 | PASS |
spack_intel-2023a_serial | -1.176087152000000e+00 | -2.172190000000462e-04 | -2.172190000000462e-01 | PASS |
spack_intel-2022a_serial_omp | -1.176087157700000e+00 | -2.172247000000738e-04 | -2.172247000000738e-01 | PASS |
spack_intel-2023a_serial_omp | -1.176087157700000e+00 | -2.172247000000738e-04 | -2.172247000000738e-01 | PASS |
spack_intel-2022a_impi_omp | -1.176087150000000e+00 | -2.172170000001028e-04 | -2.172170000001028e-01 | PASS |
spack_intel-2023a_impi | -1.176087145600000e+00 | -2.172125999999608e-04 | -2.172125999999608e-01 | PASS |