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

Commits > Commit f72050fe95608e153e1887ef05d1ad42dc082fde > Input 19-td_move_ions.03-td_restart.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.964474538961837e+01 2.960000000000000e-13 -2.964474538961839e+01 7.260009737069359e-14 -2.964474538961834e+01 1.669775429036235e-13 PASS

Checks for this match

  • Mid point of values far away from reference. Recentering may be necessary.
Loading plot...
Get updated match line Get updated match line with fixed reference

Detailed information

Reference: -29.64474538961837, precision: 0.000000000000296
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -2.964474538961841e+01 -3.552713678800501e-14 -1.200241107702872e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -2.964474538961841e+01 -3.552713678800501e-14 -1.200241107702872e-01 PASS
foss-serial-min: [foss2023a-serial] -2.964474538961841e+01 -3.552713678800501e-14 -1.200241107702872e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -2.964474538961842e+01 -4.618527782440651e-14 -1.560313440013734e-01 PASS
foss-serial-min: [foss2022a-serial] -2.964474538961841e+01 -3.552713678800501e-14 -1.200241107702872e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -2.964474538961845e+01 -8.171241461241152e-14 -2.760554547716605e-01 PASS
foss-serial-full: [foss2023b-serial] -2.964474538961841e+01 -3.552713678800501e-14 -1.200241107702872e-01 PASS
foss-serial-min: [foss2023b-serial] -2.964474538961841e+01 -3.552713678800501e-14 -1.200241107702872e-01 PASS
foss-opt-full: [foss2023a-serial] -2.964474538961841e+01 -3.552713678800501e-14 -1.200241107702872e-01 PASS
foss-ppc: [foss2022a-serial] -2.964474538961817e+01 2.025046796916286e-13 6.841374313906370e-01 PASS
foss-serial-full: [foss2023a-serial] -2.964474538961841e+01 -3.552713678800501e-14 -1.200241107702872e-01 PASS
foss-serial-debug: [foss2023a-serial] -2.964474538961841e+01 -3.552713678800501e-14 -1.200241107702872e-01 PASS
intel_omp_autotools: [intel2023a-serial] -2.964474538961833e+01 3.907985046680551e-14 1.320265218473159e-01 PASS
intel_omp_autotools: [intel2022a-serial] -2.964474538961833e+01 3.907985046680551e-14 1.320265218473159e-01 PASS
foss-omp-full: [foss2023a-serial] -2.964474538961850e+01 -1.314504061156185e-13 -4.440892098500626e-01 PASS
foss-mpi-full: [foss2023a-mpi] -2.964474538961840e+01 -2.842170943040401e-14 -9.601928861622976e-02 PASS
intel_mpi_autotools: [intel2023a-mpi] -2.964474538961825e+01 1.243449787580175e-13 4.200843876960052e-01 PASS
intel-serial: [intel2023a-serial] -2.964474538961823e+01 1.421085471520200e-13 4.800964430811488e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] -2.964474538961841e+01 -3.552713678800501e-14 -1.200241107702872e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -2.964474538961841e+01 -3.552713678800501e-14 -1.200241107702872e-01 PASS
foss-mpi-opt-full: [foss2023a-mpi] -2.964474538961842e+01 -4.618527782440651e-14 -1.560313440013734e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -2.964474538961842e+01 -4.618527782440651e-14 -1.560313440013734e-01 PASS
foss-mpi-debug: [foss2023a-mpi] -2.964474538961840e+01 -2.842170943040401e-14 -9.601928861622976e-02 PASS
foss-mpi-min: [foss2022a-mpi] -2.964474538961845e+01 -8.171241461241152e-14 -2.760554547716605e-01 PASS
foss-mpi-min: [foss2023a-mpi] -2.964474538961845e+01 -8.171241461241152e-14 -2.760554547716605e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -2.964474538961842e+01 -4.618527782440651e-14 -1.560313440013734e-01 PASS
foss-mpi-omp-full: [foss2023a-mpi] -2.964474538961842e+01 -4.618527782440651e-14 -1.560313440013734e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -2.964474538961845e+01 -8.171241461241152e-14 -2.760554547716605e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -2.964474538961845e+01 -8.171241461241152e-14 -2.760554547716605e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -2.964474538961823e+01 1.421085471520200e-13 4.800964430811488e-01 PASS
cuda-serial: [foss2022a-cuda-mpi] -2.964474538961841e+01 -3.907985046680551e-14 -1.320265218473159e-01 PASS
cuda-mpi-omp: [foss2022a-cuda-mpi] -2.964474538961842e+01 -4.618527782440651e-14 -1.560313440013734e-01 PASS