Match comparison for Forces [step 15] (match type 22547)

Commits > Commit 3186a8a51be7ad5a27ccff6e8e2901df0a16a559 > Input 05-time_propagation.06-td_fast_md.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.049280232292293e-02 2.000000000000000e-14 -1.049280232292718e-02 7.105047837490545e-15 -1.049280232292416e-02 1.609823385706477e-14 PASS

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Detailed information

Reference: -0.01049280232292293, precision: 0.00000000000002
Run Value Difference Relative difference Status
spack_foss-2023a_serial_min -1.049280232292182e-02 1.106753577673203e-15 5.533767888366015e-02 PASS
spack_foss-2023a_serial_opt -1.049280232292493e-02 -2.001870891277235e-15 -1.000935445638618e-01 PASS
spack_foss-2022a_serial -1.049280232292182e-02 1.106753577673203e-15 5.533767888366015e-02 PASS
spack_foss-2022a_serial_min -1.049280232292182e-02 1.106753577673203e-15 5.533767888366015e-02 PASS
spack_foss-2022a_ppc -1.049280232290806e-02 1.487351908302514e-14 7.436759541512572e-01 PASS
spack_foss-2023a_serial -1.049280232292182e-02 1.106753577673203e-15 5.533767888366015e-02 PASS
spack_foss-2023b_serial -1.049280232292182e-02 1.106753577673203e-15 5.533767888366015e-02 PASS
spack_foss-2022a_mpi_min -1.049280232292671e-02 -3.778227730677486e-15 -1.889113865338743e-01 PASS
spack_foss-2023a_mpi_min -1.049280232292671e-02 -3.778227730677486e-15 -1.889113865338743e-01 PASS
spack_foss-2023a_serial_omp -1.049280232292515e-02 -2.223915496202267e-15 -1.111957748101133e-01 PASS
spack_foss-2023a_mpi_opt -1.049280232292671e-02 -3.778227730677486e-15 -1.889113865338743e-01 PASS
spack_foss-2022a_mpi -1.049280232292671e-02 -3.778227730677486e-15 -1.889113865338743e-01 PASS
spack_foss-2023a_mpi -1.049280232292671e-02 -3.778227730677486e-15 -1.889113865338743e-01 PASS
spack_foss-2023a_serial_debug -1.049280232292182e-02 1.106753577673203e-15 5.533767888366015e-02 PASS
GCI_foss-cmake: [foss2022a-serial, foss-min] -1.049280232292493e-02 -2.001870891277235e-15 -1.000935445638618e-01 PASS
GCI_foss_opt_autotools: [foss2023a-serial] -1.049280232292493e-02 -2.001870891277235e-15 -1.000935445638618e-01 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] -1.049280232292493e-02 -2.001870891277235e-15 -1.000935445638618e-01 PASS
spack_foss-2023a_mpi_debug -1.049280232292671e-02 -3.778227730677486e-15 -1.889113865338743e-01 PASS
GCI_intel_autotools: [intel2023a-serial] -1.049280232293937e-02 -1.643477021140427e-14 -8.217385105702135e-01 PASS
GCI_intel_omp_autotools: [intel2023a-serial] -1.049280232294025e-02 -1.732294863110440e-14 -8.661474315552198e-01 PASS
GCI_intel_omp_autotools: [intel2022a-serial] -1.049280232294025e-02 -1.732294863110440e-14 -8.661474315552198e-01 PASS
GCI_foss_omp_autotools: [foss2023a-serial] -1.049280232292515e-02 -2.223915496202267e-15 -1.111957748101133e-01 PASS
GCI_foss_ppc_autotools: [foss2022a-serial] -1.049280232290806e-02 1.487351908302514e-14 7.436759541512572e-01 PASS
GCI_foss_min_autotools: [foss2022a-serial] -1.049280232292182e-02 1.106753577673203e-15 5.533767888366015e-02 PASS
GCI_foss_min_autotools: [foss2023a-serial] -1.049280232292182e-02 1.106753577673203e-15 5.533767888366015e-02 PASS
GCI_foss_min_autotools: [foss2023b-serial] -1.049280232292182e-02 1.106753577673203e-15 5.533767888366015e-02 PASS
GCI_foss_autotools: [foss2022a-serial] -1.049280232292182e-02 1.106753577673203e-15 5.533767888366015e-02 PASS
GCI_foss_autotools: [foss2023b-serial] -1.049280232292182e-02 1.106753577673203e-15 5.533767888366015e-02 PASS
GCI_foss_autotools: [foss2023a-serial] -1.049280232292182e-02 1.106753577673203e-15 5.533767888366015e-02 PASS
GCI_foss_debug_autotools: [foss2023a-serial] -1.049280232292182e-02 1.106753577673203e-15 5.533767888366015e-02 PASS
spack_foss-2023a_mpi_omp -1.049280232292471e-02 -1.779826286352204e-15 -8.899131431761020e-02 PASS
GCI_foss_mpi_autotools: [foss2022a-mpi] -1.049280232292671e-02 -3.778227730677486e-15 -1.889113865338743e-01 PASS
GCI_foss_mpi_autotools: [foss2023a-mpi] -1.049280232292671e-02 -3.778227730677486e-15 -1.889113865338743e-01 PASS
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] -1.049280232292471e-02 -1.779826286352204e-15 -8.899131431761020e-02 PASS
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] -1.049280232292671e-02 -3.778227730677486e-15 -1.889113865338743e-01 PASS
cmake_foss_2022a_full_serial -1.049280232292493e-02 -2.001870891277235e-15 -1.000935445638618e-01 PASS
cmake_foss_2022a_min_serial -1.049280232292493e-02 -2.001870891277235e-15 -1.000935445638618e-01 PASS
cmake_foss_2022a_min_mpi -1.049280232292626e-02 -3.334138520827423e-15 -1.667069260413712e-01 PASS
cmake_foss_2022a_full_mpi -1.049280232292671e-02 -3.778227730677486e-15 -1.889113865338743e-01 PASS
spack_intel-2022a_impi_omp -1.049280232294003e-02 -1.710090402617936e-14 -8.550452013089682e-01 PASS
spack_intel-2023a_serial -1.049280232293937e-02 -1.643477021140427e-14 -8.217385105702135e-01 PASS
spack_intel-2022a_serial_omp -1.049280232294025e-02 -1.732294863110440e-14 -8.661474315552198e-01 PASS
spack_intel-2023a_serial_omp -1.049280232294025e-02 -1.732294863110440e-14 -8.661474315552198e-01 PASS
spack_intel-2023a_impi -1.049280232293781e-02 -1.488045797692905e-14 -7.440228988464526e-01 PASS
GCI_foss_cuda_autotools: [foss2022a-cuda-mpi] -1.049280232293115e-02 -8.219119829178112e-15 -4.109559914589056e-01 PASS
spack_foss-2022a_cuda_mpi_omp -1.049280232293381e-02 -1.088365508827849e-14 -5.441827544139244e-01 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] -1.049280232292671e-02 -3.778227730677486e-15 -1.889113865338743e-01 PASS
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] -1.049280232292671e-02 -3.778227730677486e-15 -1.889113865338743e-01 PASS
GCI_foss_mpi_min_autotools: [foss2022a-mpi] -1.049280232292804e-02 -5.110495360227674e-15 -2.555247680113837e-01 PASS
GCI_foss_mpi_min_autotools: [foss2023a-mpi] -1.049280232292804e-02 -5.110495360227674e-15 -2.555247680113837e-01 PASS
spack_foss-2022a_cuda_serial -1.049280232293115e-02 -8.219119829178112e-15 -4.109559914589056e-01 PASS
GCI_intel_mpi_autotools: [intel2023a-mpi] -1.049280232293781e-02 -1.488045797692905e-14 -7.440228988464526e-01 PASS
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] -1.049280232293803e-02 -1.510250258185408e-14 -7.551251290927041e-01 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] -1.049280232292626e-02 -3.334138520827423e-15 -1.667069260413712e-01 PASS