Match comparison for Energy [step 20] (match type 14051)

Commits > Commit bf0f47cf3302df97f9487d18148dd4e0cf599eb9 > Input 19-td_move_ions.02-td.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.964454116297200e+01 1.480000000000000e-11 -2.964454116297176e+01 1.978913771406678e-13 -2.964454116297170e+01 3.250733016102458e-13 PASS
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Detailed information

Reference: -29.644541162972, precision: 0.0000000000148
Run Value Difference Relative difference Status
foss-2022a_ppc -2.964454116297162e+01 3.836930773104541e-13 2.592520792638203e-02 PASS
cmake_foss_2022a_full_serial -2.964454116297161e+01 3.907985046680551e-13 2.640530436946318e-02 PASS
cmake_foss_2022a_min_serial -2.964454116297161e+01 3.907985046680551e-13 2.640530436946318e-02 PASS
cmake_foss_2022a_full_mpi -2.964454116297203e+01 -2.486899575160351e-14 -1.680337550784021e-03 PASS
eb_fosscuda-2022a -2.964454116297163e+01 3.730349362740526e-13 2.520506326176031e-02 PASS
cmake_foss_2022a_min_mpi -2.964454116297200e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
eb_foss-2022a -2.964454116297163e+01 3.730349362740526e-13 2.520506326176031e-02 PASS
eb_foss-2022a_debug -2.964454116297163e+01 3.730349362740526e-13 2.520506326176031e-02 PASS
eb_foss-2022b_libxc6 -2.964454116297163e+01 3.730349362740526e-13 2.520506326176031e-02 PASS
eb_foss-2022a_mpi -2.964454116297201e+01 -1.421085471520200e-14 -9.601928861622975e-04 PASS
foss-2022a_opt -2.964454116297163e+01 3.730349362740526e-13 2.520506326176031e-02 PASS
foss-2022a_omp -2.964454116297194e+01 6.039613253960852e-14 4.080819766189765e-03 PASS
eb_foss-2022b_libxc6_mpi -2.964454116297201e+01 -1.421085471520200e-14 -9.601928861622975e-04 PASS
intel-2022a -2.964454116297138e+01 6.252776074688882e-13 4.224848699114109e-02 PASS
eb_foss-2022a_mpi_debug -2.964454116297201e+01 -1.421085471520200e-14 -9.601928861622975e-04 PASS
intel-2022b -2.964454116297138e+01 6.252776074688882e-13 4.224848699114109e-02 PASS
eb_fosscuda-2022a_mpi_omp -2.964454116297198e+01 1.776356839400250e-14 1.200241107702872e-03 PASS
spack_foss-2022a_serial -2.964454116297162e+01 3.801403636316536e-13 2.568515970484146e-02 PASS
intel-2022a_omp -2.964454116297176e+01 2.415845301584341e-13 1.632327906475906e-02 PASS
intel-2022a_impi -2.964454116297185e+01 1.492139745096210e-13 1.008202530470412e-02 PASS
spack_foss-2022a_serial_min -2.964454116297162e+01 3.801403636316536e-13 2.568515970484146e-02 PASS
foss-2022a_mpi_omp -2.964454116297199e+01 1.065814103640150e-14 7.201446646217231e-04 PASS
intel-2022b_impi -2.964454116297185e+01 1.492139745096210e-13 1.008202530470412e-02 PASS
spack_foss-2022a_serial_debug -2.964454116297162e+01 3.801403636316536e-13 2.568515970484146e-02 PASS
spack_foss-2022a_serial_omp -2.964454116297194e+01 6.039613253960852e-14 4.080819766189765e-03 PASS
intel-2022a_omp_impi -2.964454116297182e+01 1.847411112976260e-13 1.248250752010987e-02 PASS