Match comparison for Forces [step 20] (match type 22548)

Commits > Commit 8520a932a983b5c1584256e5aef0dad9a7dbc2f2 > Input 05-time_propagation.06-td_fast_md.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-9.513371027100001e-03 4.760000000000000e-12 -9.513371027088602e-03 6.671081058269939e-15 -9.513371027083051e-03 1.609823385706477e-14 PASS

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Detailed information

Reference: -0.0095133710271, precision: 0.00000000000476
Run Value Difference Relative difference Status
foss-2022a_ppc -9.513371027066952e-03 3.304821694083415e-14 6.942902718662637e-03 PASS
cmake_foss_2022a_full_serial -9.513371027086936e-03 1.306420249758133e-14 2.744580356634734e-03 PASS
spack_foss-2022a_serial -9.513371027086048e-03 1.395238091728146e-14 2.931172461613752e-03 PASS
foss-2022a_opt -9.513371027086492e-03 1.350829170743140e-14 2.837876409124243e-03 PASS
intel-2022b -9.513371027096262e-03 3.738329090730019e-15 7.853632543550461e-04 PASS
intel-2022a -9.513371027096262e-03 3.738329090730019e-15 7.853632543550461e-04 PASS
cmake_foss_2022a_min_mpi -9.513371027086048e-03 1.395238091728146e-14 2.931172461613752e-03 PASS
spack_foss-2022a_serial_debug -9.513371027086048e-03 1.395238091728146e-14 2.931172461613752e-03 PASS
cmake_foss_2022a_full_mpi -9.513371027084938e-03 1.506260394190662e-14 3.164412592837524e-03 PASS
foss-2022a_omp -9.513371027087825e-03 1.217602407788121e-14 2.557988251655716e-03 PASS
eb_fosscuda-2022a -9.513371027092932e-03 7.068998164605489e-15 1.485083648026363e-03 PASS
cmake_foss_2022a_min_serial -9.513371027086936e-03 1.306420249758133e-14 2.744580356634734e-03 PASS
intel-2022a_omp -9.513371027098261e-03 1.739927646404738e-15 3.655310181522558e-04 PASS
intel-2022b_impi -9.513371027098483e-03 1.517883041479706e-15 3.188829919075013e-04 PASS
intel-2022a_impi -9.513371027098483e-03 1.517883041479706e-15 3.188829919075013e-04 PASS
foss-2022a_mpi_omp -9.513371027084050e-03 1.595078236160674e-14 3.351004697816542e-03 PASS
eb_foss-2022a -9.513371027087825e-03 1.217602407788121e-14 2.557988251655716e-03 PASS
spack_foss-2022a_serial_min -9.513371027086048e-03 1.395238091728146e-14 2.931172461613752e-03 PASS
eb_foss-2022b_libxc6 -9.513371027086714e-03 1.328624710250637e-14 2.791228382879489e-03 PASS
eb_fosscuda-2022a_mpi_omp -9.513371027093154e-03 6.846953559680458e-15 1.438435621781609e-03 PASS
eb_foss-2022a_debug -9.513371027087825e-03 1.217602407788121e-14 2.557988251655716e-03 PASS
spack_foss-2022a_serial_omp -9.513371027086714e-03 1.328624710250637e-14 2.791228382879489e-03 PASS
intel-2022a_omp_impi -9.513371027099149e-03 8.517492267046123e-16 1.789389131732379e-04 PASS
eb_foss-2022a_mpi -9.513371027084272e-03 1.572873775668171e-14 3.304356671571788e-03 PASS
eb_foss-2022b_libxc6_mpi -9.513371027084716e-03 1.528464854683165e-14 3.211060619082279e-03 PASS
eb_foss-2022a_mpi_debug -9.513371027084272e-03 1.572873775668171e-14 3.304356671571788e-03 PASS