Match comparison for Total energy (match type 29763)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -2.079684332000000e+01 | 2.940000000000000e-04 | -2.079708501740741e+01 | 8.350597124771265e-05 | -2.079688740500000e+01 | 2.225449999997409e-04 | 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: -20.79684332, precision: 0.000294| Run | Value | Difference | Relative difference | Status |
| spack_foss-2022a_serial_min | -2.079710592000000e+01 | -2.625999999992246e-04 | -8.931972789089271e-01 | PASS |
| spack_foss-2023a_serial_min | -2.079710592000000e+01 | -2.625999999992246e-04 | -8.931972789089271e-01 | PASS |
| spack_foss-2022a_serial | -2.079710592000000e+01 | -2.625999999992246e-04 | -8.931972789089271e-01 | PASS |
| spack_foss-2023a_serial_opt | -2.079710605000000e+01 | -2.627299999993227e-04 | -8.936394557800091e-01 | PASS |
| spack_foss-2023a_serial | -2.079710592000000e+01 | -2.625999999992246e-04 | -8.931972789089271e-01 | PASS |
| spack_foss-2023b_serial | -2.079710592000000e+01 | -2.625999999992246e-04 | -8.931972789089271e-01 | PASS |
| spack_foss-2022a_ppc | -2.079710539000000e+01 | -2.620699999980047e-04 | -8.913945578163427e-01 | PASS |
| spack_foss-2023a_mpi_min | -2.079710546000000e+01 | -2.621400000002438e-04 | -8.916326530620540e-01 | PASS |
| spack_foss-2022a_mpi_min | -2.079710546000000e+01 | -2.621400000002438e-04 | -8.916326530620540e-01 | PASS |
| spack_foss-2023a_serial_omp | -2.079710459000000e+01 | -2.612699999993140e-04 | -8.886734693854218e-01 | PASS |
| spack_foss-2023a_serial_debug | -2.079710592000000e+01 | -2.625999999992246e-04 | -8.931972789089271e-01 | PASS |
| cmake_foss_2022a_full_mpi | -2.079710289000000e+01 | -2.595700000007639e-04 | -8.828911564651835e-01 | PASS |
| spack_foss-2023a_mpi_opt | -2.079710289000000e+01 | -2.595700000007639e-04 | -8.828911564651835e-01 | PASS |
| spack_foss-2022a_cuda_serial | -2.079666486000000e+01 | 1.784600000007686e-04 | 6.070068027237026e-01 | PASS |
| spack_foss-2022a_mpi | -2.079710546000000e+01 | -2.621400000002438e-04 | -8.916326530620540e-01 | PASS |
| spack_foss-2023a_mpi | -2.079710546000000e+01 | -2.621400000002438e-04 | -8.916326530620540e-01 | PASS |
| spack_foss-2023a_mpi_debug | -2.079710546000000e+01 | -2.621400000002438e-04 | -8.916326530620540e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -2.079703655000000e+01 | -1.932300000007103e-04 | -6.572448979615998e-01 | PASS |
| spack_foss-2023a_mpi_omp | -2.079710995000000e+01 | -2.666299999987132e-04 | -9.069047619003849e-01 | PASS |
| cmake_foss_2022a_full_serial | -2.079710605000000e+01 | -2.627299999993227e-04 | -8.936394557800091e-01 | PASS |
| cmake_foss_2022a_min_serial | -2.079710605000000e+01 | -2.627299999993227e-04 | -8.936394557800091e-01 | PASS |
| cmake_foss_2022a_min_mpi | -2.079709703000000e+01 | -2.537099999990744e-04 | -8.629591836703211e-01 | PASS |
| spack_intel-2023a_serial | -2.079710604000000e+01 | -2.627199999984953e-04 | -8.936054421717526e-01 | PASS |
| spack_intel-2022a_serial_omp | -2.079708868000000e+01 | -2.453600000009715e-04 | -8.345578231325560e-01 | PASS |
| spack_intel-2023a_serial_omp | -2.079708868000000e+01 | -2.453600000009715e-04 | -8.345578231325560e-01 | PASS |
| spack_intel-2023a_impi | -2.079710187000000e+01 | -2.585499999980811e-04 | -8.794217687009563e-01 | PASS |
| spack_intel-2022a_impi_omp | -2.079710508000000e+01 | -2.617600000007769e-04 | -8.903401360570644e-01 | PASS |