Match comparison for gga_x_mpw91 Eigenvalue dn (match type 12331)
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
-8.189245000000001e-01 | 4.120000000000000e-05 | -8.189564444444444e-01 | 1.964185503294295e-05 | -8.189245000000001e-01 | 3.749999999996811e-05 | PASS |
Checks for this match
- GPU builders have different values.
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Detailed information
Reference: -0.8189245, precision: 0.0000412Run | Value | Difference | Relative difference | Status |
spack_foss-2022a_ppc | -8.189620000000000e-01 | -3.749999999991260e-05 | -9.101941747551603e-01 | PASS |
cmake_foss_2022a_full_serial | -8.189620000000000e-01 | -3.749999999991260e-05 | -9.101941747551603e-01 | PASS |
cmake_foss_2022a_min_serial | -8.189620000000000e-01 | -3.749999999991260e-05 | -9.101941747551603e-01 | PASS |
spack_foss-2022a_cuda_mpi_omp | -8.188870000000000e-01 | 3.750000000002363e-05 | 9.101941747578550e-01 | PASS |
cmake_foss_2022a_min_mpi | -8.189620000000000e-01 | -3.749999999991260e-05 | -9.101941747551603e-01 | PASS |
cmake_foss_2022a_full_mpi | -8.189620000000000e-01 | -3.749999999991260e-05 | -9.101941747551603e-01 | PASS |
spack_foss-2022a_serial_min | -8.189620000000000e-01 | -3.749999999991260e-05 | -9.101941747551603e-01 | PASS |
spack_foss-2022a_serial | -8.189620000000000e-01 | -3.749999999991260e-05 | -9.101941747551603e-01 | PASS |
spack_foss-2022a_mpi_min | -8.189620000000000e-01 | -3.749999999991260e-05 | -9.101941747551603e-01 | PASS |
spack_foss-2022a_mpi | -8.189620000000000e-01 | -3.749999999991260e-05 | -9.101941747551603e-01 | PASS |
spack_foss-2023a_mpi | -8.189620000000000e-01 | -3.749999999991260e-05 | -9.101941747551603e-01 | PASS |
spack_foss-2023a_mpi_min | -8.189620000000000e-01 | -3.749999999991260e-05 | -9.101941747551603e-01 | PASS |
spack_foss-2023a_mpi_debug | -8.189620000000000e-01 | -3.749999999991260e-05 | -9.101941747551603e-01 | PASS |
spack_foss-2023a_serial | -8.189620000000000e-01 | -3.749999999991260e-05 | -9.101941747551603e-01 | PASS |
spack_foss-2023a_serial_min | -8.189620000000000e-01 | -3.749999999991260e-05 | -9.101941747551603e-01 | PASS |
spack_foss-2022a_cuda_serial | -8.188870000000000e-01 | 3.750000000002363e-05 | 9.101941747578550e-01 | PASS |
spack_foss-2023a_mpi_opt | -8.189620000000000e-01 | -3.749999999991260e-05 | -9.101941747551603e-01 | PASS |
spack_foss-2023a_serial_debug | -8.189620000000000e-01 | -3.749999999991260e-05 | -9.101941747551603e-01 | PASS |
spack_foss-2023a_serial_opt | -8.189620000000000e-01 | -3.749999999991260e-05 | -9.101941747551603e-01 | PASS |
spack_foss-2023b_serial | -8.189620000000000e-01 | -3.749999999991260e-05 | -9.101941747551603e-01 | PASS |
spack_foss-2023a_serial_omp | -8.189620000000000e-01 | -3.749999999991260e-05 | -9.101941747551603e-01 | PASS |
spack_foss-2023a_mpi_omp | -8.189620000000000e-01 | -3.749999999991260e-05 | -9.101941747551603e-01 | PASS |
spack_intel-2023a_serial | -8.189620000000000e-01 | -3.749999999991260e-05 | -9.101941747551603e-01 | PASS |
spack_intel-2022a_serial_omp | -8.189620000000000e-01 | -3.749999999991260e-05 | -9.101941747551603e-01 | PASS |
spack_intel-2023a_serial_omp | -8.189620000000000e-01 | -3.749999999991260e-05 | -9.101941747551603e-01 | PASS |
spack_intel-2023a_impi | -8.189620000000000e-01 | -3.749999999991260e-05 | -9.101941747551603e-01 | PASS |
spack_intel-2022a_impi_omp | -8.189620000000000e-01 | -3.749999999991260e-05 | -9.101941747551603e-01 | PASS |