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

Commits > Commit eea8a333c8089a21a3b9f1d1480b55481f8cdee7 > 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 -2.964474558355806e+01 1.457445558162016e-13 -2.964474558355806e+01 1.989519660128281e-13 PASS
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Detailed information

Reference: -29.644745583558, precision: 0.00000000000148
Run Value Difference Relative difference Status
spack_foss-2023a_serial_min -2.964474558355792e+01 8.171241461241152e-14 5.521109095433211e-02 PASS
spack_foss-2022a_serial_min -2.964474558355792e+01 8.171241461241152e-14 5.521109095433211e-02 PASS
spack_foss-2022a_serial -2.964474558355792e+01 8.171241461241152e-14 5.521109095433211e-02 PASS
spack_foss-2023a_serial_opt -2.964474558355791e+01 9.237055564881302e-14 6.241253760054934e-02 PASS
spack_foss-2023a_serial -2.964474558355792e+01 8.171241461241152e-14 5.521109095433211e-02 PASS
spack_foss-2023b_serial -2.964474558355792e+01 8.171241461241152e-14 5.521109095433211e-02 PASS
spack_foss-2022a_ppc -2.964474558355792e+01 8.171241461241152e-14 5.521109095433211e-02 PASS
spack_foss-2022a_mpi_min -2.964474558355823e+01 -2.309263891220326e-13 -1.560313440013734e-01 PASS
spack_foss-2023a_mpi_min -2.964474558355823e+01 -2.309263891220326e-13 -1.560313440013734e-01 PASS
spack_foss-2023a_serial_debug -2.964474558355792e+01 8.171241461241152e-14 5.521109095433211e-02 PASS
spack_foss-2023a_serial_omp -2.964474558355811e+01 -1.101341240428155e-13 -7.441494867757806e-02 PASS
spack_foss-2022a_cuda_serial -2.964474558355786e+01 1.421085471520200e-13 9.601928861622976e-02 PASS
spack_foss-2023a_mpi_opt -2.964474558355822e+01 -2.202682480856311e-13 -1.488298973551561e-01 PASS
spack_foss-2023a_mpi -2.964474558355823e+01 -2.309263891220326e-13 -1.560313440013734e-01 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-2023a_mpi_debug -2.964474558355823e+01 -2.309263891220326e-13 -1.560313440013734e-01 PASS
spack_foss-2023a_mpi_omp -2.964474558355825e+01 -2.557953848736361e-13 -1.728347195092136e-01 PASS
cmake_foss_2022a_min_serial -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_mpi -2.964474558355819e+01 -1.918465386552271e-13 -1.296260396319102e-01 PASS
cmake_foss_2022a_full_mpi -2.964474558355822e+01 -2.202682480856311e-13 -1.488298973551561e-01 PASS
spack_intel-2022a_serial_omp -2.964474558355796e+01 3.907985046680551e-14 2.640530436946318e-02 PASS
spack_intel-2022a_impi_omp -2.964474558355807e+01 -7.105427357601002e-14 -4.800964430811488e-02 PASS
spack_intel-2023a_serial_omp -2.964474558355796e+01 3.907985046680551e-14 2.640530436946318e-02 PASS
spack_intel-2023a_impi -2.964474558355803e+01 -3.197442310920451e-14 -2.160433993865169e-02 PASS