Match comparison for Benzene Energy [step 20] (match type 20284)
Commits >
Commit 9a893b9dbe73f1d3f49cd24e2707361da541a5ca >
Input 12-tddft-currents-to-maxwell.02-benzene-mxll-td-length-gauge.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -3.744565857691556e+01 | 3.740000000000000e-13 | -3.744565857691550e+01 | 1.345891499922449e-13 | -3.744565857691556e+01 | 2.273736754432321e-13 | PASS |
Checks for this match
- GPU builders have different values. Intel® builders have different values.
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Detailed information
Reference: -37.445658576915555, precision: 0.000000000000374| Run | Value | Difference | Relative difference | Status |
| foss-serial-zen4: [foss2023a-serial] | -3.744565857691546e+01 | 9.237055564881302e-14 | 2.469800953176819e-01 | PASS |
| intel-serial: [intel2023a-serial] | -3.744565857691579e+01 | -2.344791028008331e-13 | -6.269494727295001e-01 | PASS |
| foss-serial-debug: [foss2023a-serial] | -3.744565857691544e+01 | 1.136868377216160e-13 | 3.039755019294546e-01 | PASS |
| intel-min-parallel: [intel2022a-mpi] | -3.744565857691561e+01 | -5.684341886080801e-14 | -1.519877509647273e-01 | PASS |
| intel-parallel: [intel2023a-mpi] | -3.744565857691561e+01 | -5.684341886080801e-14 | -1.519877509647273e-01 | PASS |
| foss-parallel-zen4: [foss2023a-mpi] | -3.744565857691541e+01 | 1.492139745096210e-13 | 3.989678462824092e-01 | PASS |
| foss-min-parallel-zen4: [foss2023a-mpi] | -3.744565857691542e+01 | 1.350031197944190e-13 | 3.609709085412273e-01 | PASS |
| autotools_foss_mpi_omp: [foss2023a-mpi] | -3.744565857691542e+01 | 1.350031197944190e-13 | 3.609709085412273e-01 | PASS |
| foss-serial: [foss2023a-serial] | -3.744565857691544e+01 | 1.136868377216160e-13 | 3.039755019294546e-01 | PASS |
| foss-parallel-debug: [foss2023a-mpi] | -3.744565857691542e+01 | 1.350031197944190e-13 | 3.609709085412273e-01 | PASS |
| ppc: [foss2023a-serial] | -3.744565857691560e+01 | -4.263256414560601e-14 | -1.139908132235455e-01 | PASS |
| cuda: [foss2022a-cuda-mpi, ci-foss-full-cuda] | -3.744565857691533e+01 | 2.202682480856311e-13 | 5.889525349883183e-01 | PASS |
| autotools_intel_mpi_omp: [intel2023a-mpi] | -3.744565857691562e+01 | -6.394884621840902e-14 | -1.709862198353182e-01 | PASS |
| intel-serial-debug: [intel2023a-serial] | -3.744565857691579e+01 | -2.344791028008331e-13 | -6.269494727295001e-01 | PASS |
| foss-parallel: [foss2023a-mpi] | -3.744565857691542e+01 | 1.350031197944190e-13 | 3.609709085412273e-01 | PASS |
| foss-min-parallel: [foss2023b-mpi] | -3.744565857691538e+01 | 1.776356839400250e-13 | 4.749617217647728e-01 | PASS |
| intel-parallel-debug: [intel2023a-mpi] | -3.744565857691561e+01 | -5.684341886080801e-14 | -1.519877509647273e-01 | PASS |
| cuda: [foss2022a-cuda-mpi, ci-foss-full-mpi-omp-cuda] | -3.744565857691533e+01 | 2.202682480856311e-13 | 5.889525349883183e-01 | PASS |
| foss-min-parallel: [foss2022a-mpi] | -3.744565857691545e+01 | 1.065814103640150e-13 | 2.849770330588637e-01 | PASS |