Match comparison for MVORB HSE06 Fock Total (match type 23351)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -7.874097100000000e-01 | 6.090000000000000e-06 | -7.874151604000000e-01 | 7.942191134764731e-08 | -7.874151700000001e-01 | 8.000000001340268e-08 | PASS |
Checks for this match
- MPI builders have different values.
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: -0.78740971, precision: 0.00000609| Run | Value | Difference | Relative difference | Status |
| spack_foss-2023a_mpi_debug | -7.874152500000000e-01 | -5.539999999970568e-06 | -9.096880131314562e-01 | PASS |
| spack_foss-2023a_mpi_omp | -7.874152500000000e-01 | -5.539999999970568e-06 | -9.096880131314562e-01 | PASS |
| cmake_foss_2022a_min_serial | -7.874150900000000e-01 | -5.379999999943763e-06 | -8.834154351303387e-01 | PASS |
| cmake_foss_2022a_full_serial | -7.874150900000000e-01 | -5.379999999943763e-06 | -8.834154351303387e-01 | PASS |
| cmake_foss_2022a_min_mpi | -7.874152500000000e-01 | -5.539999999970568e-06 | -9.096880131314562e-01 | PASS |
| cmake_foss_2022a_full_mpi | -7.874152500000000e-01 | -5.539999999970568e-06 | -9.096880131314562e-01 | PASS |
| spack_intel-2023a_serial | -7.874150900000000e-01 | -5.379999999943763e-06 | -8.834154351303387e-01 | PASS |
| spack_intel-2022a_impi_omp | -7.874152500000000e-01 | -5.539999999970568e-06 | -9.096880131314562e-01 | PASS |
| spack_intel-2022a_serial_omp | -7.874150900000000e-01 | -5.379999999943763e-06 | -8.834154351303387e-01 | PASS |
| spack_intel-2023a_serial_omp | -7.874150900000000e-01 | -5.379999999943763e-06 | -8.834154351303387e-01 | PASS |
| spack_intel-2023a_impi | -7.874152500000000e-01 | -5.539999999970568e-06 | -9.096880131314562e-01 | PASS |
| spack_foss-2022a_serial_min | -7.874150900000000e-01 | -5.379999999943763e-06 | -8.834154351303387e-01 | PASS |
| spack_foss-2023a_serial_min | -7.874150900000000e-01 | -5.379999999943763e-06 | -8.834154351303387e-01 | PASS |
| spack_foss-2022a_serial | -7.874150900000000e-01 | -5.379999999943763e-06 | -8.834154351303387e-01 | PASS |
| spack_foss-2023a_serial | -7.874150900000000e-01 | -5.379999999943763e-06 | -8.834154351303387e-01 | PASS |
| spack_foss-2023a_serial_opt | -7.874150900000000e-01 | -5.379999999943763e-06 | -8.834154351303387e-01 | PASS |
| spack_foss-2023b_serial | -7.874150900000000e-01 | -5.379999999943763e-06 | -8.834154351303387e-01 | PASS |
| spack_foss-2022a_ppc | -7.874150900000000e-01 | -5.379999999943763e-06 | -8.834154351303387e-01 | PASS |
| spack_foss-2023a_mpi_min | -7.874152500000000e-01 | -5.539999999970568e-06 | -9.096880131314562e-01 | PASS |
| spack_foss-2022a_mpi_min | -7.874152500000000e-01 | -5.539999999970568e-06 | -9.096880131314562e-01 | PASS |
| spack_foss-2023a_serial_omp | -7.874150900000000e-01 | -5.379999999943763e-06 | -8.834154351303387e-01 | PASS |
| spack_foss-2023a_serial_debug | -7.874150900000000e-01 | -5.379999999943763e-06 | -8.834154351303387e-01 | PASS |
| spack_foss-2023a_mpi_opt | -7.874152500000000e-01 | -5.539999999970568e-06 | -9.096880131314562e-01 | PASS |
| spack_foss-2022a_mpi | -7.874152500000000e-01 | -5.539999999970568e-06 | -9.096880131314562e-01 | PASS |
| spack_foss-2023a_mpi | -7.874152500000000e-01 | -5.539999999970568e-06 | -9.096880131314562e-01 | PASS |