Match comparison for Benzene Energy [step 20] (match type 23475)

Commits > Commit 467aee6bb6aa6bf5b31aed5cccd88bd7f10f5124 > 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 -3.744565214494917e+01 6.872521413906120e-14 -3.744565214494921e+01 1.385558334732195e-13 PASS

Checks for this match

    Intel® builders have different values.
  • Mid point of values far away from reference. Recentering may be necessary.
Loading plot...
Get updated match line Get updated match line with fixed reference

Detailed information

Reference: -37.44565206480256, precision: 0.00000009
Run Value Difference Relative difference Status
foss-2022a_ppc -3.744565214494921e+01 -8.014664842903585e-08 -8.905183158781761e-01 PASS
spack_foss-2022a_serial_opt -3.744565214494916e+01 -8.014660579647170e-08 -8.905178421830190e-01 PASS
spack_foss-2022a_serial_min -3.744565214494916e+01 -8.014660579647170e-08 -8.905178421830190e-01 PASS
spack_foss-2022a_serial -3.744565214494916e+01 -8.014660579647170e-08 -8.905178421830190e-01 PASS
foss-2022a_opt -3.744565214494918e+01 -8.014662000732642e-08 -8.905180000814047e-01 PASS
intel-2022b -3.744565214494935e+01 -8.014679053758300e-08 -8.905198948620333e-01 PASS
intel-2022a -3.744565214494935e+01 -8.014679053758300e-08 -8.905198948620333e-01 PASS
spack_foss-2022a_serial_omp -3.744565214494915e+01 -8.014659158561699e-08 -8.905176842846332e-01 PASS
spack_foss-2022a_serial_debug -3.744565214494916e+01 -8.014660579647170e-08 -8.905178421830190e-01 PASS
foss-2022a_omp -3.744565214494918e+01 -8.014662000732642e-08 -8.905180000814047e-01 PASS
spack_foss-2022a_mpi -3.744565214494909e+01 -8.014652763677077e-08 -8.905169737418974e-01 PASS
intel-2022a_omp -3.744565214494924e+01 -8.014667685074528e-08 -8.905186316749476e-01 PASS
intel-2022a_impi -3.744565214494922e+01 -8.014666263989056e-08 -8.905184737765618e-01 PASS
cmake_foss_2022a_full_mpi -3.744565214494909e+01 -8.014652763677077e-08 -8.905169737418974e-01 PASS
spack_foss-2022a_mpi_omp -3.744565214494916e+01 -8.014660579647170e-08 -8.905178421830190e-01 PASS
eb_fosscuda-2022a -3.744565214494918e+01 -8.014662000732642e-08 -8.905180000814047e-01 PASS
cmake_foss_2022a_full_serial -3.744565214494916e+01 -8.014660579647170e-08 -8.905178421830190e-01 PASS
cmake_foss_2022a_min_serial -3.744565214494916e+01 -8.014660579647170e-08 -8.905178421830190e-01 PASS
foss-2022a_mpi_omp -3.744565214494916e+01 -8.014660579647170e-08 -8.905178421830190e-01 PASS
cmake_foss_2022a_min_mpi -3.744565214494907e+01 -8.014651342591605e-08 -8.905168158435117e-01 PASS
eb_foss-2022a -3.744565214494918e+01 -8.014662000732642e-08 -8.905180000814047e-01 PASS
eb_foss-2022b_libxc6 -3.744565214494919e+01 -8.014662711275378e-08 -8.905180790305975e-01 PASS
intel-2022a_omp_impi -3.744565214494925e+01 -8.014669106160000e-08 -8.905187895733333e-01 PASS
eb_foss-2022a_debug -3.744565214494918e+01 -8.014662000732642e-08 -8.905180000814047e-01 PASS
eb_foss-2022a_mpi -3.744565214494908e+01 -8.014652053134341e-08 -8.905168947927046e-01 PASS
eb_foss-2022b_libxc6_mpi -3.744565214494909e+01 -8.014653474219813e-08 -8.905170526910903e-01 PASS
eb_foss-2022a_mpi_debug -3.744565214494908e+01 -8.014652053134341e-08 -8.905168947927046e-01 PASS
eb_fosscuda-2022a_mpi_omp -3.744565214494908e+01 -8.014652053134341e-08 -8.905168947927046e-01 PASS
intel-2022b_impi -3.744565214494922e+01 -8.014666263989056e-08 -8.905184737765618e-01 PASS