Match comparison for Forces [step 1] (match type 17471)

Commits > Commit 4eed2c655b9f478fca43a397c5feb863f7436add > Input 03-td_self_consistent.02-etrs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
8.537492460197621e-02 6.750000000000000e-15 8.537492460197582e-02 1.906094831483608e-15 8.537492460197726e-02 4.662936703425657e-15 PASS

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Detailed information

Reference: 0.08537492460197621, precision: 0.00000000000000675
Run Value Difference Relative difference Status
eb_foss-2022a_ppc 8.537492460198193e-02 5.717648576819556e-15 8.470590484177121e-01 PASS
cmake_foss_2022a_full_serial 8.537492460197527e-02 -9.436895709313831e-16 -1.398058623602049e-01 PASS
cmake_foss_2022a_min_serial 8.537492460197527e-02 -9.436895709313831e-16 -1.398058623602049e-01 PASS
cmake_foss_2022a_full_mpi 8.537492460197704e-02 8.326672684688674e-16 1.233581138472396e-01 PASS
eb_fosscuda-2022a 8.537492460197749e-02 1.276756478318930e-15 1.891491078991007e-01 PASS
cmake_foss_2022a_min_mpi 8.537492460197704e-02 8.326672684688674e-16 1.233581138472396e-01 PASS
eb_foss-2022a_debug 8.537492460197660e-02 3.885780586188048e-16 5.756711979537849e-02 PASS
eb_foss-2022b_libxc6 8.537492460197393e-02 -2.275957200481571e-15 -3.371788445157883e-01 PASS
eb_intel-2022a 8.537492460197571e-02 -4.996003610813204e-16 -7.401486830834378e-02 PASS
eb_foss-2022b_libxc6_mpi 8.537492460197482e-02 -1.387778780781446e-15 -2.055968564120660e-01 PASS
intel-2022b 8.537492460197571e-02 -4.996003610813204e-16 -7.401486830834378e-02 PASS
eb_intel-2022a_omp 8.537492460197882e-02 2.609024107869118e-15 3.865220900546841e-01 PASS
eb_foss-2022a_mpi_debug 8.537492460197438e-02 -1.831867990631508e-15 -2.713878504639272e-01 PASS
eb_intel-2022a_impi 8.537492460197527e-02 -9.436895709313831e-16 -1.398058623602049e-01 PASS
spack_foss-2022a_serial 8.537492460197482e-02 -1.387778780781446e-15 -2.055968564120660e-01 PASS
spack_foss-2022a_mpi 8.537492460197438e-02 -1.831867990631508e-15 -2.713878504639272e-01 PASS
spack_foss-2022a_cuda_mpi_omp 8.537492460197926e-02 3.053113317719180e-15 4.523130841065453e-01 PASS
spack_foss-2022a_serial_min 8.537492460197482e-02 -1.387778780781446e-15 -2.055968564120660e-01 PASS
intel-2022b_impi 8.537492460197527e-02 -9.436895709313831e-16 -1.398058623602049e-01 PASS
spack_foss-2022a_serial_debug 8.537492460197482e-02 -1.387778780781446e-15 -2.055968564120660e-01 PASS
spack_foss-2022a_serial_omp 8.537492460197527e-02 -9.436895709313831e-16 -1.398058623602049e-01 PASS
spack_foss-2022a_serial_opt 8.537492460197527e-02 -9.436895709313831e-16 -1.398058623602049e-01 PASS
spack_foss-2022a_mpi_omp 8.537492460197438e-02 -1.831867990631508e-15 -2.713878504639272e-01 PASS
eb_intel-2022a_omp_impi 8.537492460197527e-02 -9.436895709313831e-16 -1.398058623602049e-01 PASS
eb_foss-2022a_valgrind 8.537492460197260e-02 -3.608224830031759e-15 -5.345518266713717e-01 PASS