Match comparison for Energy [step 0] (match type 12075)
Commits >
Commit eea8a333c8089a21a3b9f1d1480b55481f8cdee7 >
Input 14-fullerene_unpacked.03-td-packed.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -3.184210032772400e+02 | 1.590000000000000e-10 | -3.184210032772129e+02 | 5.038202794284104e-11 | -3.184210032771822e+02 | 6.119194040365983e-11 | PASS |
Checks for this match
- Mid point of values far away from reference. Recentering may be necessary.
Loading plot...
Detailed information
Reference: -318.42100327724, precision: 0.000000000159| Run | Value | Difference | Relative difference | Status |
| spack_foss-2023a_serial_min | -3.184210032771210e+02 | 1.190301190945320e-10 | 7.486171012234716e-01 | PASS |
| spack_foss-2022a_serial_min | -3.184210032771210e+02 | 1.190301190945320e-10 | 7.486171012234716e-01 | PASS |
| spack_foss-2022a_serial | -3.184210032771210e+02 | 1.190301190945320e-10 | 7.486171012234716e-01 | PASS |
| spack_foss-2023a_serial_opt | -3.184210032772406e+02 | -6.252776074688882e-13 | -3.932563568986718e-03 | PASS |
| spack_foss-2023a_serial | -3.184210032771210e+02 | 1.190301190945320e-10 | 7.486171012234716e-01 | PASS |
| spack_foss-2023b_serial | -3.184210032771210e+02 | 1.190301190945320e-10 | 7.486171012234716e-01 | PASS |
| spack_foss-2022a_ppc | -3.184210032772396e+02 | 3.979039320256561e-13 | 2.502540452991548e-03 | PASS |
| spack_foss-2022a_mpi_min | -3.184210032772399e+02 | 5.684341886080801e-14 | 3.575057789987925e-04 | PASS |
| spack_foss-2023a_mpi_min | -3.184210032772399e+02 | 5.684341886080801e-14 | 3.575057789987925e-04 | PASS |
| spack_foss-2023a_serial_debug | -3.184210032771210e+02 | 1.190301190945320e-10 | 7.486171012234716e-01 | PASS |
| spack_foss-2023a_serial_omp | -3.184210032772386e+02 | 1.421085471520200e-12 | 8.937644474969813e-03 | PASS |
| spack_foss-2022a_cuda_serial | -3.184210032772401e+02 | -5.684341886080801e-14 | -3.575057789987925e-04 | PASS |
| spack_foss-2023a_mpi_opt | -3.184210032772434e+02 | -3.353761712787673e-12 | -2.109284096092876e-02 | PASS |
| spack_foss-2023a_mpi | -3.184210032772418e+02 | -1.818989403545856e-12 | -1.144018492796136e-02 | PASS |
| spack_foss-2022a_mpi | -3.184210032772409e+02 | -9.094947017729282e-13 | -5.720092463980681e-03 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -3.184210032772415e+02 | -1.534772309241816e-12 | -9.652656032967399e-03 | PASS |
| spack_foss-2023a_mpi_debug | -3.184210032772414e+02 | -1.364242052659392e-12 | -8.580138695971021e-03 | PASS |
| spack_foss-2023a_mpi_omp | -3.184210032772398e+02 | 2.273736754432321e-13 | 1.430023115995170e-03 | PASS |
| cmake_foss_2022a_min_serial | -3.184210032772406e+02 | -6.252776074688882e-13 | -3.932563568986718e-03 | PASS |
| cmake_foss_2022a_full_serial | -3.184210032772406e+02 | -6.252776074688882e-13 | -3.932563568986718e-03 | PASS |
| cmake_foss_2022a_min_mpi | -3.184210032772425e+02 | -2.501110429875553e-12 | -1.573025427594687e-02 | PASS |
| cmake_foss_2022a_full_mpi | -3.184210032772399e+02 | 5.684341886080801e-14 | 3.575057789987925e-04 | PASS |
| spack_intel-2022a_serial_omp | -3.184210032772399e+02 | 5.684341886080801e-14 | 3.575057789987925e-04 | PASS |
| spack_intel-2022a_impi_omp | -3.184210032772385e+02 | 1.534772309241816e-12 | 9.652656032967399e-03 | PASS |
| spack_intel-2023a_serial_omp | -3.184210032772404e+02 | -3.979039320256561e-13 | -2.502540452991548e-03 | PASS |
| spack_intel-2023a_impi | -3.184210032772405e+02 | -5.115907697472721e-13 | -3.217552010989133e-03 | PASS |