Match comparison for Benzene Energy [step 20] (match type 23475)
Commits >
Commit babc485c55a2119a415aa56305cb49f398154cb7 >
Input 12-tddft-currents-to-maxwell.04-benzene-mxll-td-full-min-coup.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -3.744565206480256e+01 | 9.000000000000000e-08 | -3.744565214494918e+01 | 7.671852926672265e-14 | -3.744565214494922e+01 | 1.350031197944190e-13 | PASS |
Checks for this match
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Detailed information
Reference: -37.44565206480256, precision: 0.00000009| Run | Value | Difference | Relative difference | Status |
| spack_foss-2022a_ppc | -3.744565214494932e+01 | -8.014676211587357e-08 | -8.905195790652619e-01 | PASS |
| spack_foss-2022a_cuda_serial | -3.744565214494916e+01 | -8.014660579647170e-08 | -8.905178421830190e-01 | PASS |
| spack_foss-2022a_serial | -3.744565214494916e+01 | -8.014660579647170e-08 | -8.905178421830190e-01 | PASS |
| spack_foss-2022a_mpi | -3.744565214494909e+01 | -8.014652763677077e-08 | -8.905169737418974e-01 | PASS |
| spack_foss-2022a_serial_min | -3.744565214494916e+01 | -8.014660579647170e-08 | -8.905178421830190e-01 | PASS |
| spack_foss-2022a_mpi_min | -3.744565214494909e+01 | -8.014652763677077e-08 | -8.905169737418974e-01 | PASS |
| spack_foss-2022a_mpi_opt | -3.744565214494909e+01 | -8.014652763677077e-08 | -8.905169737418974e-01 | PASS |
| spack_foss-2022a_serial_opt | -3.744565214494916e+01 | -8.014660579647170e-08 | -8.905178421830190e-01 | PASS |
| spack_foss-2022a_serial_debug | -3.744565214494916e+01 | -8.014660579647170e-08 | -8.905178421830190e-01 | PASS |
| spack_foss-2023a_serial | -3.744565214494916e+01 | -8.014660579647170e-08 | -8.905178421830190e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -3.744565214494909e+01 | -8.014652763677077e-08 | -8.905169737418974e-01 | PASS |
| spack_foss-2023a_serial_omp | -3.744565214494914e+01 | -8.014658448018963e-08 | -8.905176053354403e-01 | PASS |
| spack_foss-2022a_mpi_debug | -3.744565214494909e+01 | -8.014652763677077e-08 | -8.905169737418974e-01 | PASS |
| spack_foss-2023a_serial_min | -3.744565214494916e+01 | -8.014660579647170e-08 | -8.905178421830190e-01 | PASS |
| spack_intel-2022a_serial_omp | -3.744565214494924e+01 | -8.014667685074528e-08 | -8.905186316749476e-01 | PASS |
| spack_intel-2023a_serial | -3.744565214494936e+01 | -8.014679764301036e-08 | -8.905199738112263e-01 | PASS |
| spack_intel-2023a_serial_omp | -3.744565214494924e+01 | -8.014667685074528e-08 | -8.905186316749476e-01 | PASS |
| spack_intel-2023a_impi | -3.744565214494925e+01 | -8.014669106160000e-08 | -8.905187895733333e-01 | PASS |
| spack_intel-2022a_impi_omp | -3.744565214494924e+01 | -8.014667685074528e-08 | -8.905186316749476e-01 | PASS |