Match comparison for Energy [step 1] (match type 14077)

Commits > Commit 6816b153d33f61198d1ef96fd0f4ab733dba1073 > Input 05-time_propagation.05-td_md.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.791009280177000e+01 1.900000000000000e-10 -3.791009280177384e+01 5.647651421362557e-14 -3.791009280177384e+01 7.460698725481052e-14 PASS
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Detailed information

Reference: -37.91009280177, precision: 0.00000000019
Run Value Difference Relative difference Status
foss-2022a_ppc -3.791009280177379e+01 -3.787192781601334e-12 -1.993259358737544e-02 PASS
spack_foss-2022a_serial -3.791009280177379e+01 -3.787192781601334e-12 -1.993259358737544e-02 PASS
foss-2022a_opt -3.791009280177380e+01 -3.801403636316536e-12 -2.000738755956072e-02 PASS
spack_foss-2022a_serial_min -3.791009280177379e+01 -3.787192781601334e-12 -1.993259358737544e-02 PASS
eb_foss-2022a -3.791009280177380e+01 -3.801403636316536e-12 -2.000738755956072e-02 PASS
foss-2022a_omp -3.791009280177389e+01 -3.886668764607748e-12 -2.045615139267236e-02 PASS
spack_foss-2022a_serial_debug -3.791009280177379e+01 -3.787192781601334e-12 -1.993259358737544e-02 PASS
eb_foss-2022b_libxc6 -3.791009280177379e+01 -3.794298208958935e-12 -1.996999057346808e-02 PASS
eb_fosscuda-2022a -3.791009280177377e+01 -3.772981926886132e-12 -1.985779961519017e-02 PASS
spack_foss-2022a_serial_omp -3.791009280177389e+01 -3.893774191965349e-12 -2.049354837876500e-02 PASS
eb_foss-2022a_debug -3.791009280177380e+01 -3.801403636316536e-12 -2.000738755956072e-02 PASS
spack_foss-2022a_serial_opt -3.791009280177379e+01 -3.794298208958935e-12 -1.996999057346808e-02 PASS
eb_foss-2022a_mpi -3.791009280177391e+01 -3.907985046680551e-12 -2.056834235095027e-02 PASS
eb_foss-2022b_libxc6_mpi -3.791009280177392e+01 -3.922195901395753e-12 -2.064313632313554e-02 PASS
eb_fosscuda-2022a_mpi_omp -3.791009280177392e+01 -3.922195901395753e-12 -2.064313632313554e-02 PASS
eb_foss-2022a_mpi_debug -3.791009280177391e+01 -3.907985046680551e-12 -2.056834235095027e-02 PASS
foss-2022a_mpi_omp -3.791009280177389e+01 -3.886668764607748e-12 -2.045615139267236e-02 PASS