Match comparison for Energy [step 20] (match type 24686)

Commits > Commit 1bf2bc61d0085049d6bd7294e2825d85d95584e0 > Input 22-td_move_ions_periodic.02-td.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.470793229358995e+01 1.920000000000000e-11 -2.470793229360036e+01 8.951234671446067e-14 -2.470793229360035e+01 1.509903313490213e-13 PASS

Checks for this match

  • MPI builders have different values.
  • Mid point of values far away from reference. Recentering may be necessary.
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Detailed information

Reference: -24.70793229358995, precision: 0.0000000000192
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-full] -2.470793229360039e+01 -1.044142550199467e-11 -5.438242448955559e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-min] -2.470793229360043e+01 -1.048050535246148e-11 -5.458596537740353e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -2.470793229360020e+01 -1.024957896333945e-11 -5.338322376739295e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -2.470793229360023e+01 -1.028510610012745e-11 -5.356826093816380e-01 PASS
foss-serial-min: [foss2023a-serial] -2.470793229360044e+01 -1.049116349349788e-11 -5.464147652863479e-01 PASS
foss-serial-min: [foss2022a-serial] -2.470793229360044e+01 -1.049116349349788e-11 -5.464147652863479e-01 PASS
foss-serial-min: [foss2023b-serial] -2.470793229360044e+01 -1.049116349349788e-11 -5.464147652863479e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] -2.470793229360044e+01 -1.049116349349788e-11 -5.464147652863479e-01 PASS
foss-serial-full: [foss2023a-serial] -2.470793229360044e+01 -1.049116349349788e-11 -5.464147652863479e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -2.470793229360044e+01 -1.049116349349788e-11 -5.464147652863479e-01 PASS
foss-serial-full: [foss2023b-serial] -2.470793229360044e+01 -1.049116349349788e-11 -5.464147652863479e-01 PASS
foss-opt-full: [foss2023a-serial] -2.470793229360044e+01 -1.049116349349788e-11 -5.464147652863479e-01 PASS
intel-serial: [intel2023a-serial] -2.470793229360050e+01 -1.055155962603749e-11 -5.495603971894525e-01 PASS
foss-serial-debug: [foss2023a-serial] -2.470793229360044e+01 -1.049116349349788e-11 -5.464147652863479e-01 PASS
foss-ppc: [foss2022a-serial] -2.470793229360049e+01 -1.053734877132229e-11 -5.488202485063691e-01 PASS
intel-omp: [intel2023a-serial] -2.470793229360047e+01 -1.051958520292828e-11 -5.478950626525148e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -2.470793229360027e+01 -1.031708052323665e-11 -5.373479439185758e-01 PASS
foss-mpi-opt-full: [foss2023a-mpi] -2.470793229360027e+01 -1.031708052323665e-11 -5.373479439185758e-01 PASS
foss-omp-full: [foss2023a-serial] -2.470793229360039e+01 -1.044142550199467e-11 -5.438242448955559e-01 PASS
intel-omp: [intel2022a-serial] -2.470793229360047e+01 -1.051958520292828e-11 -5.478950626525148e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -2.470793229360027e+01 -1.031708052323665e-11 -5.373479439185758e-01 PASS
foss-mpi-full: [foss2023a-mpi] -2.470793229360027e+01 -1.031708052323665e-11 -5.373479439185758e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -2.470793229360027e+01 -1.032418595059426e-11 -5.377180182601176e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -2.470793229360027e+01 -1.032418595059426e-11 -5.377180182601176e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -2.470793229360035e+01 -1.040234565152787e-11 -5.417888360170764e-01 PASS
foss-mpi-min: [foss2022a-mpi] -2.470793229360027e+01 -1.032418595059426e-11 -5.377180182601176e-01 PASS
foss-mpi-min: [foss2023a-mpi] -2.470793229360027e+01 -1.032418595059426e-11 -5.377180182601176e-01 PASS
foss-mpi-omp-full: [foss2023a-mpi] -2.470793229360026e+01 -1.031352780955785e-11 -5.371629067478050e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -2.470793229360033e+01 -1.038102936945506e-11 -5.406786129924512e-01 PASS
cuda-serial: [foss2022a-cuda-mpi] -2.470793229360036e+01 -1.041300379256427e-11 -5.423439475293890e-01 PASS
cuda-mpi-omp: [foss2022a-cuda-mpi] -2.470793229360028e+01 -1.033484409163066e-11 -5.382731297724301e-01 PASS
foss-mpi-debug: [foss2023a-mpi] -2.470793229360027e+01 -1.031708052323665e-11 -5.373479439185758e-01 PASS