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

Commits > Commit 3d047708c1ab8d71894fb240c9b3cff2ecebd198 > 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 -1.587430653996584e+01 3.624023730026933e-14 -1.587430653996586e+01 9.148237722911290e-14 PASS

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Detailed information

Reference: -15.874306539965849, precision: 0.000000000000159
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -1.587430653996583e+01 1.953992523340276e-14 1.228926115308349e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -1.587430653996583e+01 1.953992523340276e-14 1.228926115308349e-01 PASS
foss-ppc: [foss2022a-serial] -1.587430653996595e+01 -1.048050535246148e-13 -6.591512800290238e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -1.587430653996583e+01 1.421085471520200e-14 8.937644474969814e-02 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -1.587430653996582e+01 2.664535259100376e-14 1.675808339056840e-01 PASS
foss-serial-full: [foss2023a-serial] -1.587430653996585e+01 -1.776356839400250e-15 -1.117205559371227e-02 PASS
foss-serial-full: [foss2023b-serial] -1.587430653996585e+01 -1.776356839400250e-15 -1.117205559371227e-02 PASS
intel_omp_autotools: [intel2022a-serial] -1.587430653996581e+01 4.263256414560601e-14 2.681293342490944e-01 PASS
intel_omp_autotools: [intel2023a-serial] -1.587430653996581e+01 4.263256414560601e-14 2.681293342490944e-01 PASS
foss-serial-min: [foss2022a-serial] -1.587430653996585e+01 -1.776356839400250e-15 -1.117205559371227e-02 PASS
foss-serial-debug: [foss2023a-serial] -1.587430653996585e+01 -1.776356839400250e-15 -1.117205559371227e-02 PASS
foss-serial-min: [foss2023a-serial] -1.587430653996585e+01 -1.776356839400250e-15 -1.117205559371227e-02 PASS
foss-serial-min: [foss2023b-serial] -1.587430653996585e+01 -1.776356839400250e-15 -1.117205559371227e-02 PASS
foss-opt-full: [foss2023a-serial] -1.587430653996585e+01 3.552713678800501e-15 2.234411118742453e-02 PASS
foss_cmake: [foss2022a-serial, foss-min] -1.587430653996585e+01 3.552713678800501e-15 2.234411118742453e-02 PASS
intel-serial: [intel2023a-serial] -1.587430653996580e+01 4.796163466380676e-14 3.016455010302312e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -1.587430653996585e+01 3.552713678800501e-15 2.234411118742453e-02 PASS
intel_mpi_autotools: [intel2023a-mpi] -1.587430653996579e+01 5.506706202140776e-14 3.463337234050803e-01 PASS
foss-omp-full: [foss2023a-serial] -1.587430653996585e+01 3.552713678800501e-15 2.234411118742453e-02 PASS
foss-mpi-opt-full: [foss2023a-mpi] -1.587430653996586e+01 -8.881784197001252e-15 -5.586027796856134e-02 PASS
foss-mpi-full: [foss2023a-mpi] -1.587430653996586e+01 -8.881784197001252e-15 -5.586027796856134e-02 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -1.587430653996586e+01 -8.881784197001252e-15 -5.586027796856134e-02 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -1.587430653996586e+01 -8.881784197001252e-15 -5.586027796856134e-02 PASS
foss-mpi-min: [foss2023a-mpi] -1.587430653996581e+01 3.730349362740526e-14 2.346131674679576e-01 PASS
foss-mpi-debug: [foss2023a-mpi] -1.587430653996586e+01 -8.881784197001252e-15 -5.586027796856134e-02 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -1.587430653996584e+01 8.881784197001252e-15 5.586027796856134e-02 PASS
foss-mpi-min: [foss2022a-mpi] -1.587430653996581e+01 3.730349362740526e-14 2.346131674679576e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -1.587430653996584e+01 8.881784197001252e-15 5.586027796856134e-02 PASS
foss-mpi-omp-full: [foss2023a-mpi] -1.587430653996585e+01 3.552713678800501e-15 2.234411118742453e-02 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -1.587430653996577e+01 7.815970093361102e-14 4.915704461233397e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -1.587430653996594e+01 -8.881784197001252e-14 -5.586027796856133e-01 PASS
cuda-serial: [foss2022a-cuda-mpi] -1.587430653996591e+01 -6.039613253960852e-14 -3.798498901862171e-01 PASS