Match comparison for Energy [step 1] (match type 14080)

Commits > Commit b1773e3237a9e3fe1d68ecd7146c17ebbd95a961 > Input 05-time_propagation.06-td_fast_md.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.791009280177380e+01 1.900000000000000e-12 -3.791009280177385e+01 7.664922615477603e-14 -3.791009280177386e+01 1.456612608308205e-13 PASS
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Detailed information

Reference: -37.9100928017738, precision: 0.0000000000019
Run Value Difference Relative difference Status
GCI_foss_min_autotools: [foss2023a-serial] -3.791009280177379e+01 7.105427357601002e-15 3.739698609263685e-03 PASS
GCI_foss_opt_autotools: [foss2023a-serial] -3.791009280177379e+01 1.421085471520200e-14 7.479397218527370e-03 PASS
cmake_foss_2022a_full_serial -3.791009280177379e+01 1.421085471520200e-14 7.479397218527370e-03 PASS
GCI_foss_autotools: [foss2022a-serial] -3.791009280177379e+01 7.105427357601002e-15 3.739698609263685e-03 PASS
GCI_foss_autotools: [foss2023b-serial] -3.791009280177379e+01 7.105427357601002e-15 3.739698609263685e-03 PASS
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] -3.791009280177392e+01 -1.207922650792170e-13 -6.357487635748264e-02 PASS
spack_foss-2023a_serial_min -3.791009280177379e+01 7.105427357601002e-15 3.739698609263685e-03 PASS
spack_foss-2022a_serial_min -3.791009280177379e+01 7.105427357601002e-15 3.739698609263685e-03 PASS
spack_foss-2022a_ppc -3.791009280177379e+01 1.421085471520200e-14 7.479397218527370e-03 PASS
spack_foss-2022a_serial -3.791009280177379e+01 7.105427357601002e-15 3.739698609263685e-03 PASS
GCI_intel_omp_autotools: [intel2022a-serial] -3.791009280177381e+01 -1.421085471520200e-14 -7.479397218527370e-03 PASS
spack_foss-2023a_serial -3.791009280177379e+01 7.105427357601002e-15 3.739698609263685e-03 PASS
cmake_foss_2022a_min_mpi -3.791009280177390e+01 -9.947598300641403e-14 -5.235578052969159e-02 PASS
GCI_foss-cmake: [foss2022a-serial, foss-min] -3.791009280177379e+01 1.421085471520200e-14 7.479397218527370e-03 PASS
GCI_foss_mpi_min_autotools: [foss2022a-mpi] -3.791009280177392e+01 -1.207922650792170e-13 -6.357487635748264e-02 PASS
GCI_foss_debug_autotools: [foss2023a-serial] -3.791009280177379e+01 7.105427357601002e-15 3.739698609263685e-03 PASS
spack_foss-2022a_mpi_min -3.791009280177394e+01 -1.421085471520200e-13 -7.479397218527370e-02 PASS
spack_foss-2023a_mpi_min -3.791009280177394e+01 -1.421085471520200e-13 -7.479397218527370e-02 PASS
GCI_foss_mpi_autotools: [foss2022a-mpi] -3.791009280177394e+01 -1.421085471520200e-13 -7.479397218527370e-02 PASS
GCI_foss_ppc_autotools: [foss2022a-serial] -3.791009280177379e+01 1.421085471520200e-14 7.479397218527370e-03 PASS
cmake_foss_2022a_full_mpi -3.791009280177392e+01 -1.207922650792170e-13 -6.357487635748264e-02 PASS
spack_foss-2023a_mpi_opt -3.791009280177392e+01 -1.207922650792170e-13 -6.357487635748264e-02 PASS
cmake_foss_2022a_min_serial -3.791009280177379e+01 1.421085471520200e-14 7.479397218527370e-03 PASS
spack_foss-2023a_serial_debug -3.791009280177379e+01 7.105427357601002e-15 3.739698609263685e-03 PASS
spack_foss-2022a_mpi -3.791009280177394e+01 -1.421085471520200e-13 -7.479397218527370e-02 PASS
spack_foss-2023a_mpi -3.791009280177394e+01 -1.421085471520200e-13 -7.479397218527370e-02 PASS
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] -3.791009280177394e+01 -1.421085471520200e-13 -7.479397218527370e-02 PASS
GCI_foss_min_autotools: [foss2023b-serial] -3.791009280177379e+01 7.105427357601002e-15 3.739698609263685e-03 PASS
spack_foss-2023a_mpi_debug -3.791009280177394e+01 -1.421085471520200e-13 -7.479397218527370e-02 PASS
spack_foss-2023a_mpi_omp -3.791009280177391e+01 -1.136868377216160e-13 -5.983517774821896e-02 PASS
GCI_foss_autotools: [foss2023a-serial] -3.791009280177379e+01 7.105427357601002e-15 3.739698609263685e-03 PASS
GCI_foss_min_autotools: [foss2022a-serial] -3.791009280177379e+01 7.105427357601002e-15 3.739698609263685e-03 PASS
spack_foss-2022a_cuda_mpi_omp -3.791009280177391e+01 -1.136868377216160e-13 -5.983517774821896e-02 PASS
GCI_intel_autotools: [intel2023a-serial] -3.791009280177400e+01 -1.989519660128281e-13 -1.047115610593832e-01 PASS
GCI_foss_mpi_autotools: [foss2023a-mpi] -3.791009280177394e+01 -1.421085471520200e-13 -7.479397218527370e-02 PASS
spack_foss-2023a_serial_opt -3.791009280177379e+01 1.421085471520200e-14 7.479397218527370e-03 PASS
GCI_foss_mpi_min_autotools: [foss2023a-mpi] -3.791009280177392e+01 -1.207922650792170e-13 -6.357487635748264e-02 PASS
GCI_foss_omp_autotools: [foss2023a-serial] -3.791009280177391e+01 -1.136868377216160e-13 -5.983517774821896e-02 PASS
spack_foss-2023a_serial_omp -3.791009280177391e+01 -1.136868377216160e-13 -5.983517774821896e-02 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] -3.791009280177379e+01 1.421085471520200e-14 7.479397218527370e-03 PASS
spack_foss-2023b_serial -3.791009280177379e+01 7.105427357601002e-15 3.739698609263685e-03 PASS
spack_intel-2023a_serial -3.791009280177400e+01 -1.989519660128281e-13 -1.047115610593832e-01 PASS
spack_intel-2022a_serial_omp -3.791009280177381e+01 -1.421085471520200e-14 -7.479397218527370e-03 PASS
GCI_intel_omp_autotools: [intel2023a-serial] -3.791009280177381e+01 -1.421085471520200e-14 -7.479397218527370e-03 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] -3.791009280177390e+01 -9.947598300641403e-14 -5.235578052969159e-02 PASS
spack_intel-2023a_serial_omp -3.791009280177381e+01 -1.421085471520200e-14 -7.479397218527370e-03 PASS
GCI_foss_cuda_autotools: [foss2022a-cuda-mpi] -3.791009280177377e+01 2.842170943040401e-14 1.495879443705474e-02 PASS
GCI_intel_mpi_autotools: [intel2023a-mpi] -3.791009280177375e+01 4.973799150320701e-14 2.617789026484580e-02 PASS
spack_intel-2023a_impi -3.791009280177372e+01 7.815970093361102e-14 4.113668470190054e-02 PASS
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] -3.791009280177391e+01 -1.136868377216160e-13 -5.983517774821896e-02 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] -3.791009280177392e+01 -1.207922650792170e-13 -6.357487635748264e-02 PASS
GCI_foss-cmake: [foss2023a-mpi, foss-min-mpi] -3.791009280177390e+01 -9.947598300641403e-14 -5.235578052969159e-02 PASS
GCI_foss-cmake: [foss2023a-mpi, foss-full-mpi] -3.791009280177392e+01 -1.207922650792170e-13 -6.357487635748264e-02 PASS
spack_intel-2022a_impi_omp -3.791009280177371e+01 9.237055564881302e-14 4.861608192042791e-02 PASS
spack_foss-2022a_cuda_serial -3.791009280177377e+01 2.842170943040401e-14 1.495879443705474e-02 PASS
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] -3.791009280177372e+01 7.815970093361102e-14 4.113668470190054e-02 PASS
GCI_foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -3.791009280177391e+01 -1.136868377216160e-13 -5.983517774821896e-02 PASS