Match comparison for Forces [step 5] (match type 22545)

Commits > Commit 467aee6bb6aa6bf5b31aed5cccd88bd7f10f5124 > Input 05-time_propagation.06-td_fast_md.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-7.618874990413800e-03 1.590000000000000e-14 -7.618874990417165e-03 5.502581197211486e-15 -7.618874990417135e-03 1.132427485117660e-14 PASS

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Detailed information

Reference: -0.0076188749904138, precision: 0.0000000000000159
Run Value Difference Relative difference Status
foss-2022a_ppc -7.618874990405811e-03 7.989268968611185e-15 5.024697464535336e-01 PASS
spack_foss-2022a_serial_opt -7.618874990413804e-03 -4.336808689942018e-18 -2.727552635183659e-04 PASS
spack_foss-2022a_serial_min -7.618874990413138e-03 6.617970060851519e-16 4.162245321290264e-02 PASS
spack_foss-2022a_serial -7.618874990413138e-03 6.617970060851519e-16 4.162245321290264e-02 PASS
foss-2022a_opt -7.618874990413804e-03 -4.336808689942018e-18 -2.727552635183659e-04 PASS
intel-2022b -7.618874990423130e-03 -9.330210215541257e-15 -5.868056739334123e-01 PASS
intel-2022a -7.618874990423130e-03 -9.330210215541257e-15 -5.868056739334123e-01 PASS
spack_foss-2022a_serial_omp -7.618874990413360e-03 4.397524011601206e-16 2.765738372076230e-02 PASS
spack_foss-2022a_serial_debug -7.618874990413138e-03 6.617970060851519e-16 4.162245321290264e-02 PASS
foss-2022a_omp -7.618874990411806e-03 1.994064635635340e-15 1.254128701657446e-01 PASS
spack_foss-2022a_mpi -7.618874990419355e-03 -5.555451931815725e-15 -3.493994925670267e-01 PASS
intel-2022a_omp -7.618874990422908e-03 -9.108165610616226e-15 -5.728406044412720e-01 PASS
intel-2022a_impi -7.618874990425129e-03 -1.132861165986654e-14 -7.124912993626754e-01 PASS
cmake_foss_2022a_full_mpi -7.618874990417579e-03 -3.779095092415474e-15 -2.376789366299040e-01 PASS
spack_foss-2022a_mpi_omp -7.618874990418911e-03 -5.111362721965662e-15 -3.214693535827460e-01 PASS
eb_fosscuda-2022a -7.618874990423796e-03 -9.996344030316351e-15 -6.287008824098334e-01 PASS
cmake_foss_2022a_full_serial -7.618874990413804e-03 -4.336808689942018e-18 -2.727552635183659e-04 PASS
cmake_foss_2022a_min_serial -7.618874990413804e-03 -4.336808689942018e-18 -2.727552635183659e-04 PASS
foss-2022a_mpi_omp -7.618874990414914e-03 -1.114559833315099e-15 -7.009810272422003e-02 PASS
cmake_foss_2022a_min_mpi -7.618874990417357e-03 -3.557050487490443e-15 -2.237138671377637e-01 PASS
eb_foss-2022a -7.618874990411140e-03 2.660198450410434e-15 1.673080786421656e-01 PASS
eb_foss-2022b_libxc6 -7.618874990411584e-03 2.216109240560371e-15 1.393779396578850e-01 PASS
intel-2022a_omp_impi -7.618874990428459e-03 -1.465928073374201e-14 -9.219673417447803e-01 PASS
eb_foss-2022a_debug -7.618874990411140e-03 2.660198450410434e-15 1.673080786421656e-01 PASS
eb_foss-2022a_mpi -7.618874990416691e-03 -2.890916672715349e-15 -1.818186586613427e-01 PASS
eb_foss-2022b_libxc6_mpi -7.618874990418467e-03 -4.667273512115599e-15 -2.935392145984654e-01 PASS
eb_foss-2022a_mpi_debug -7.618874990416691e-03 -2.890916672715349e-15 -1.818186586613427e-01 PASS
eb_fosscuda-2022a_mpi_omp -7.618874990426683e-03 -1.288292389434176e-14 -8.102467858076577e-01 PASS
intel-2022b_impi -7.618874990425129e-03 -1.132861165986654e-14 -7.124912993626754e-01 PASS