Match comparison for Energy [step 20] (match type 24686)
Commits >
Commit bf0f47cf3302df97f9487d18148dd4e0cf599eb9 >
Input 22-td_move_ions_periodic.02-td.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -2.470792539565124e+01 | 2.470000000000000e-13 | -2.470792539565122e+01 | 3.353795294332937e-14 | -2.470792539565122e+01 | 6.572520305780927e-14 | PASS |
Checks for this match
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Detailed information
Reference: -24.70792539565124, precision: 0.000000000000247| Run | Value | Difference | Relative difference | Status |
| foss-2022a_ppc | -2.470792539565124e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| cmake_foss_2022a_full_serial | -2.470792539565124e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| cmake_foss_2022a_min_serial | -2.470792539565124e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| cmake_foss_2022a_full_mpi | -2.470792539565119e+01 | 4.973799150320701e-14 | 2.013683866526600e-01 | PASS |
| eb_fosscuda-2022a | -2.470792539565119e+01 | 4.973799150320701e-14 | 2.013683866526600e-01 | PASS |
| cmake_foss_2022a_min_mpi | -2.470792539565121e+01 | 3.552713678800501e-14 | 1.438345618947571e-01 | PASS |
| eb_foss-2022a | -2.470792539565121e+01 | 3.197442310920451e-14 | 1.294511057052814e-01 | PASS |
| eb_foss-2022a_debug | -2.470792539565121e+01 | 3.197442310920451e-14 | 1.294511057052814e-01 | PASS |
| eb_foss-2022b_libxc6 | -2.470792539565121e+01 | 3.197442310920451e-14 | 1.294511057052814e-01 | PASS |
| eb_foss-2022a_mpi | -2.470792539565117e+01 | 7.105427357601002e-14 | 2.876691237895143e-01 | PASS |
| foss-2022a_opt | -2.470792539565121e+01 | 3.197442310920451e-14 | 1.294511057052814e-01 | PASS |
| foss-2022a_omp | -2.470792539565115e+01 | 9.237055564881302e-14 | 3.739698609263685e-01 | PASS |
| eb_foss-2022b_libxc6_mpi | -2.470792539565117e+01 | 7.105427357601002e-14 | 2.876691237895143e-01 | PASS |
| intel-2022a | -2.470792539565124e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| eb_foss-2022a_mpi_debug | -2.470792539565117e+01 | 7.105427357601002e-14 | 2.876691237895143e-01 | PASS |
| intel-2022b | -2.470792539565124e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| eb_fosscuda-2022a_mpi_omp | -2.470792539565123e+01 | 1.065814103640150e-14 | 4.315036856842713e-02 | PASS |
| spack_foss-2022a_serial | -2.470792539565124e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| intel-2022a_omp | -2.470792539565125e+01 | -7.105427357601002e-15 | -2.876691237895142e-02 | PASS |
| intel-2022a_impi | -2.470792539565125e+01 | -1.065814103640150e-14 | -4.315036856842713e-02 | PASS |
| spack_foss-2022a_serial_min | -2.470792539565124e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss-2022a_mpi_omp | -2.470792539565117e+01 | 6.750155989720952e-14 | 2.732856676000385e-01 | PASS |
| intel-2022b_impi | -2.470792539565125e+01 | -1.065814103640150e-14 | -4.315036856842713e-02 | PASS |
| spack_foss-2022a_serial_debug | -2.470792539565124e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2022a_serial_omp | -2.470792539565117e+01 | 7.105427357601002e-14 | 2.876691237895143e-01 | PASS |
| intel-2022a_omp_impi | -2.470792539565128e+01 | -3.907985046680551e-14 | -1.582180180842328e-01 | PASS |