Match comparison for X Force Atom 1 [step 20] (match type 14057)

Commits > Commit 3c86545dbb6a164adc7b03c9886fea0d0acfc59e > Input 19-td_move_ions.02-td.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.587430653996585e+01 1.590000000000000e-13 -1.587430653996585e+01 1.396968330457278e-14 -1.587430653996584e+01 3.108624468950438e-14 PASS
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Detailed information

Reference: -15.874306539965849, precision: 0.000000000000159
Run Value Difference Relative difference Status
GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] -1.587430653996584e+01 8.881784197001252e-15 5.586027796856134e-02 PASS
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] -1.587430653996585e+01 -1.776356839400250e-15 -1.117205559371227e-02 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] -1.587430653996585e+01 -1.776356839400250e-15 -1.117205559371227e-02 PASS
GCI_foss_opt_autotools: [foss2023a-serial] -1.587430653996585e+01 3.552713678800501e-15 2.234411118742453e-02 PASS
GCI_foss-cmake: [foss2022a-serial, foss-min] -1.587430653996585e+01 3.552713678800501e-15 2.234411118742453e-02 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] -1.587430653996585e+01 3.552713678800501e-15 2.234411118742453e-02 PASS
GCI_intel_autotools: [intel2023a-serial] -1.587430653996585e+01 3.552713678800501e-15 2.234411118742453e-02 PASS
GCI_foss_omp_autotools: [foss2023a-serial] -1.587430653996585e+01 -1.776356839400250e-15 -1.117205559371227e-02 PASS
GCI_intel_mpi_autotools: [intel2023a-mpi] -1.587430653996585e+01 3.552713678800501e-15 2.234411118742453e-02 PASS
GCI_intel_omp_autotools: [intel2022a-serial] -1.587430653996587e+01 -1.953992523340276e-14 -1.228926115308349e-01 PASS
GCI_intel_omp_autotools: [intel2023a-serial] -1.587430653996587e+01 -1.953992523340276e-14 -1.228926115308349e-01 PASS
GCI_foss_ppc_autotools: [foss2022a-serial] -1.587430653996587e+01 -2.486899575160351e-14 -1.564087783119717e-01 PASS
GCI_foss_min_autotools: [foss2023a-serial] -1.587430653996584e+01 8.881784197001252e-15 5.586027796856134e-02 PASS
GCI_foss_min_autotools: [foss2022a-serial] -1.587430653996584e+01 8.881784197001252e-15 5.586027796856134e-02 PASS
GCI_foss_autotools: [foss2022a-serial] -1.587430653996584e+01 8.881784197001252e-15 5.586027796856134e-02 PASS
GCI_foss_autotools: [foss2023a-serial] -1.587430653996584e+01 8.881784197001252e-15 5.586027796856134e-02 PASS
GCI_foss_min_autotools: [foss2023b-serial] -1.587430653996584e+01 8.881784197001252e-15 5.586027796856134e-02 PASS
GCI_foss_autotools: [foss2023b-serial] -1.587430653996584e+01 8.881784197001252e-15 5.586027796856134e-02 PASS
GCI_foss_debug_autotools: [foss2023a-serial] -1.587430653996584e+01 8.881784197001252e-15 5.586027796856134e-02 PASS
GCI_foss_mpi_min_autotools: [foss2022a-mpi] -1.587430653996581e+01 3.730349362740526e-14 2.346131674679576e-01 PASS
GCI_foss_mpi_min_autotools: [foss2023a-mpi] -1.587430653996581e+01 3.730349362740526e-14 2.346131674679576e-01 PASS
GCI_foss_mpi_autotools: [foss2023a-mpi] -1.587430653996583e+01 1.421085471520200e-14 8.937644474969814e-02 PASS
GCI_foss_mpi_autotools: [foss2022a-mpi] -1.587430653996583e+01 1.421085471520200e-14 8.937644474969814e-02 PASS
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] -1.587430653996583e+01 1.421085471520200e-14 8.937644474969814e-02 PASS
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] -1.587430653996583e+01 1.421085471520200e-14 8.937644474969814e-02 PASS
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] -1.587430653996586e+01 -8.881784197001252e-15 -5.586027796856134e-02 PASS