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

Commits > Commit 3186a8a51be7ad5a27ccff6e8e2901df0a16a559 > 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 -3.791009280177385e+01 7.669254793868739e-14 -3.791009280177386e+01 1.456612608308205e-13 PASS
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Detailed information

Reference: -37.91009280177, precision: 0.00000000019
Run Value Difference Relative difference Status
spack_foss-2023a_serial_min -3.791009280177379e+01 -3.794298208958935e-12 -1.996999057346808e-02 PASS
spack_foss-2023a_serial_opt -3.791009280177379e+01 -3.787192781601334e-12 -1.993259358737544e-02 PASS
spack_foss-2022a_serial -3.791009280177379e+01 -3.794298208958935e-12 -1.996999057346808e-02 PASS
spack_foss-2022a_serial_min -3.791009280177379e+01 -3.794298208958935e-12 -1.996999057346808e-02 PASS
spack_foss-2022a_ppc -3.791009280177379e+01 -3.787192781601334e-12 -1.993259358737544e-02 PASS
spack_foss-2023a_serial -3.791009280177379e+01 -3.794298208958935e-12 -1.996999057346808e-02 PASS
spack_foss-2023b_serial -3.791009280177379e+01 -3.794298208958935e-12 -1.996999057346808e-02 PASS
spack_foss-2022a_mpi_min -3.791009280177394e+01 -3.943512183468556e-12 -2.075532728141346e-02 PASS
spack_foss-2023a_mpi_min -3.791009280177394e+01 -3.943512183468556e-12 -2.075532728141346e-02 PASS
spack_foss-2023a_serial_omp -3.791009280177391e+01 -3.915090474038152e-12 -2.060573933704291e-02 PASS
spack_foss-2023a_mpi_opt -3.791009280177392e+01 -3.922195901395753e-12 -2.064313632313554e-02 PASS
spack_foss-2022a_mpi -3.791009280177394e+01 -3.943512183468556e-12 -2.075532728141346e-02 PASS
spack_foss-2023a_mpi -3.791009280177394e+01 -3.943512183468556e-12 -2.075532728141346e-02 PASS
spack_foss-2023a_serial_debug -3.791009280177379e+01 -3.794298208958935e-12 -1.996999057346808e-02 PASS
GCI_foss-cmake: [foss2022a-serial, foss-min] -3.791009280177379e+01 -3.787192781601334e-12 -1.993259358737544e-02 PASS
GCI_foss_opt_autotools: [foss2023a-serial] -3.791009280177379e+01 -3.787192781601334e-12 -1.993259358737544e-02 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] -3.791009280177379e+01 -3.787192781601334e-12 -1.993259358737544e-02 PASS
spack_foss-2023a_mpi_debug -3.791009280177394e+01 -3.943512183468556e-12 -2.075532728141346e-02 PASS
GCI_intel_autotools: [intel2023a-serial] -3.791009280177400e+01 -4.000355602329364e-12 -2.105450317015455e-02 PASS
GCI_intel_omp_autotools: [intel2023a-serial] -3.791009280177381e+01 -3.815614491031738e-12 -2.008218153174599e-02 PASS
GCI_intel_omp_autotools: [intel2022a-serial] -3.791009280177381e+01 -3.815614491031738e-12 -2.008218153174599e-02 PASS
GCI_foss_omp_autotools: [foss2023a-serial] -3.791009280177391e+01 -3.915090474038152e-12 -2.060573933704291e-02 PASS
GCI_foss_ppc_autotools: [foss2022a-serial] -3.791009280177379e+01 -3.787192781601334e-12 -1.993259358737544e-02 PASS
GCI_foss_min_autotools: [foss2022a-serial] -3.791009280177379e+01 -3.794298208958935e-12 -1.996999057346808e-02 PASS
GCI_foss_min_autotools: [foss2023a-serial] -3.791009280177379e+01 -3.794298208958935e-12 -1.996999057346808e-02 PASS
GCI_foss_min_autotools: [foss2023b-serial] -3.791009280177379e+01 -3.794298208958935e-12 -1.996999057346808e-02 PASS
GCI_foss_autotools: [foss2022a-serial] -3.791009280177379e+01 -3.794298208958935e-12 -1.996999057346808e-02 PASS
GCI_foss_autotools: [foss2023b-serial] -3.791009280177379e+01 -3.794298208958935e-12 -1.996999057346808e-02 PASS
GCI_foss_autotools: [foss2023a-serial] -3.791009280177379e+01 -3.794298208958935e-12 -1.996999057346808e-02 PASS
GCI_foss_debug_autotools: [foss2023a-serial] -3.791009280177379e+01 -3.794298208958935e-12 -1.996999057346808e-02 PASS
spack_foss-2023a_mpi_omp -3.791009280177391e+01 -3.915090474038152e-12 -2.060573933704291e-02 PASS
GCI_foss_mpi_autotools: [foss2022a-mpi] -3.791009280177394e+01 -3.943512183468556e-12 -2.075532728141346e-02 PASS
GCI_foss_mpi_autotools: [foss2023a-mpi] -3.791009280177394e+01 -3.943512183468556e-12 -2.075532728141346e-02 PASS
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] -3.791009280177391e+01 -3.915090474038152e-12 -2.060573933704291e-02 PASS
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] -3.791009280177394e+01 -3.943512183468556e-12 -2.075532728141346e-02 PASS
cmake_foss_2022a_full_serial -3.791009280177379e+01 -3.787192781601334e-12 -1.993259358737544e-02 PASS
cmake_foss_2022a_min_serial -3.791009280177379e+01 -3.787192781601334e-12 -1.993259358737544e-02 PASS
cmake_foss_2022a_min_mpi -3.791009280177390e+01 -3.900879619322950e-12 -2.053094536485763e-02 PASS
cmake_foss_2022a_full_mpi -3.791009280177392e+01 -3.922195901395753e-12 -2.064313632313554e-02 PASS
spack_intel-2022a_impi_omp -3.791009280177371e+01 -3.709033080667723e-12 -1.952122674035644e-02 PASS
spack_intel-2023a_serial -3.791009280177400e+01 -4.000355602329364e-12 -2.105450317015455e-02 PASS
spack_intel-2022a_serial_omp -3.791009280177381e+01 -3.815614491031738e-12 -2.008218153174599e-02 PASS
spack_intel-2023a_serial_omp -3.791009280177381e+01 -3.815614491031738e-12 -2.008218153174599e-02 PASS
spack_intel-2023a_impi -3.791009280177372e+01 -3.723243935382925e-12 -1.959602071254171e-02 PASS
GCI_foss_cuda_autotools: [foss2022a-cuda-mpi] -3.791009280177379e+01 -3.787192781601334e-12 -1.993259358737544e-02 PASS
spack_foss-2022a_cuda_mpi_omp -3.791009280177391e+01 -3.915090474038152e-12 -2.060573933704291e-02 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] -3.791009280177392e+01 -3.922195901395753e-12 -2.064313632313554e-02 PASS
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] -3.791009280177392e+01 -3.922195901395753e-12 -2.064313632313554e-02 PASS
GCI_foss_mpi_min_autotools: [foss2022a-mpi] -3.791009280177391e+01 -3.907985046680551e-12 -2.056834235095027e-02 PASS
GCI_foss_mpi_min_autotools: [foss2023a-mpi] -3.791009280177391e+01 -3.907985046680551e-12 -2.056834235095027e-02 PASS
spack_foss-2022a_cuda_serial -3.791009280177377e+01 -3.772981926886132e-12 -1.985779961519017e-02 PASS
GCI_intel_mpi_autotools: [intel2023a-mpi] -3.791009280177375e+01 -3.751665644813329e-12 -1.974560865691226e-02 PASS
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] -3.791009280177372e+01 -3.723243935382925e-12 -1.959602071254171e-02 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] -3.791009280177390e+01 -3.900879619322950e-12 -2.053094536485763e-02 PASS