Match comparison for Energy [step 15] (match type 14058)

Commits > Commit 4eed2c655b9f478fca43a397c5feb863f7436add > Input 19-td_move_ions.03-td_restart.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.964474558355800e+01 1.480000000000000e-12 -2.964474558355800e+01 1.855761613956073e-13 -2.964474558355791e+01 3.499422973618493e-13 PASS

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Detailed information

Reference: -29.644745583558, precision: 0.00000000000148
Run Value Difference Relative difference Status
eb_foss-2022a_ppc -2.964474558355791e+01 9.237055564881302e-14 6.241253760054934e-02 PASS
cmake_foss_2022a_full_serial -2.964474558355791e+01 9.237055564881302e-14 6.241253760054934e-02 PASS
cmake_foss_2022a_min_serial -2.964474558355791e+01 9.237055564881302e-14 6.241253760054934e-02 PASS
cmake_foss_2022a_full_mpi -2.964474558355822e+01 -2.202682480856311e-13 -1.488298973551561e-01 PASS
eb_fosscuda-2022a -2.964474558355791e+01 8.881784197001252e-14 6.001205538514360e-02 PASS
cmake_foss_2022a_min_mpi -2.964474558355819e+01 -1.918465386552271e-13 -1.296260396319102e-01 PASS
eb_foss-2022a_debug -2.964474558355794e+01 5.684341886080801e-14 3.840771544649190e-02 PASS
eb_foss-2022b_libxc6 -2.964474558355794e+01 5.684341886080801e-14 3.840771544649190e-02 PASS
eb_intel-2022a -2.964474558355755e+01 4.440892098500626e-13 3.000602769257180e-01 PASS
eb_foss-2022b_libxc6_mpi -2.964474558355821e+01 -2.096101070492296e-13 -1.416284507089389e-01 PASS
intel-2022b -2.964474558355755e+01 4.440892098500626e-13 3.000602769257180e-01 PASS
eb_intel-2022a_omp -2.964474558355796e+01 3.907985046680551e-14 2.640530436946318e-02 PASS
eb_foss-2022a_mpi_debug -2.964474558355821e+01 -2.096101070492296e-13 -1.416284507089389e-01 PASS
eb_intel-2022a_impi -2.964474558355803e+01 -2.842170943040401e-14 -1.920385772324595e-02 PASS
spack_foss-2022a_serial -2.964474558355792e+01 8.171241461241152e-14 5.521109095433211e-02 PASS
spack_foss-2022a_mpi -2.964474558355823e+01 -2.309263891220326e-13 -1.560313440013734e-01 PASS
spack_foss-2022a_cuda_mpi_omp -2.964474558355822e+01 -2.202682480856311e-13 -1.488298973551561e-01 PASS
spack_foss-2022a_serial_min -2.964474558355792e+01 8.171241461241152e-14 5.521109095433211e-02 PASS
intel-2022b_impi -2.964474558355803e+01 -2.842170943040401e-14 -1.920385772324595e-02 PASS
spack_foss-2022a_serial_debug -2.964474558355792e+01 8.171241461241152e-14 5.521109095433211e-02 PASS
spack_foss-2022a_serial_omp -2.964474558355811e+01 -1.101341240428155e-13 -7.441494867757806e-02 PASS
spack_foss-2022a_serial_opt -2.964474558355791e+01 9.237055564881302e-14 6.241253760054934e-02 PASS
spack_foss-2022a_mpi_omp -2.964474558355825e+01 -2.557953848736361e-13 -1.728347195092136e-01 PASS
eb_intel-2022a_omp_impi -2.964474558355809e+01 -8.881784197001252e-14 -6.001205538514360e-02 PASS