Match comparison for X Force Atom 1 [step 10] (match type 24691)
Commits >
Commit eddb1a976bbe1f1b2f6bb64793dd776e6572a2b5 >
Input 22-td_move_ions_periodic.02-td.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -5.427031944168380e+00 | 8.179999999999999e-12 | -5.427031944168542e+00 | 1.648297989256718e-14 | -5.427031944168533e+00 | 2.842170943040401e-14 | PASS |
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Detailed information
Reference: -5.42703194416838, precision: 0.00000000000818| Run | Value | Difference | Relative difference | Status |
| foss-cmake-zen4: [foss2023a-serial, foss-min] | -5.427031944168547e+00 | -1.669775429036235e-13 | -2.041290255545520e-02 | PASS |
| foss-cmake-zen4: [foss2023a-serial, foss-full] | -5.427031944168559e+00 | -1.785238623597252e-13 | -2.182443305131115e-02 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] | -5.427031944168551e+00 | -1.705302565824240e-13 | -2.084721963110318e-02 | PASS |
| foss_cmake: [foss2022a-serial, foss-min] | -5.427031944168545e+00 | -1.643130076445232e-13 | -2.008716474871922e-02 | PASS |
| foss-serial-min: [foss2023b-serial] | -5.427031944168545e+00 | -1.643130076445232e-13 | -2.008716474871922e-02 | PASS |
| foss-serial-min: [foss2022a-serial] | -5.427031944168545e+00 | -1.643130076445232e-13 | -2.008716474871922e-02 | PASS |
| foss-serial-min: [foss2023a-serial] | -5.427031944168545e+00 | -1.643130076445232e-13 | -2.008716474871922e-02 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | -5.427031944168545e+00 | -1.643130076445232e-13 | -2.008716474871922e-02 | PASS |
| foss-serial-full: [foss2023a-serial] | -5.427031944168545e+00 | -1.643130076445232e-13 | -2.008716474871922e-02 | PASS |
| foss-opt-full: [foss2023a-serial] | -5.427031944168545e+00 | -1.643130076445232e-13 | -2.008716474871922e-02 | PASS |
| intel-serial: [intel2023a-serial] | -5.427031944168539e+00 | -1.589839371263224e-13 | -1.943568913524724e-02 | PASS |
| foss-serial-full: [foss2023b-serial] | -5.427031944168545e+00 | -1.643130076445232e-13 | -2.008716474871922e-02 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] | -5.427031944168551e+00 | -1.705302565824240e-13 | -2.084721963110318e-02 | PASS |
| foss-ppc: [foss2022a-serial] | -5.427031944168516e+00 | -1.358912982141192e-13 | -1.661262814353535e-02 | PASS |
| foss-serial-debug: [foss2023a-serial] | -5.427031944168545e+00 | -1.643130076445232e-13 | -2.008716474871922e-02 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | -5.427031944168551e+00 | -1.705302565824240e-13 | -2.084721963110318e-02 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | -5.427031944168551e+00 | -1.705302565824240e-13 | -2.084721963110318e-02 | PASS |
| intel-omp: [intel2023a-serial] | -5.427031944168507e+00 | -1.270095140171179e-13 | -1.552683545441539e-02 | PASS |
| intel-omp: [intel2022a-serial] | -5.427031944168507e+00 | -1.270095140171179e-13 | -1.552683545441539e-02 | PASS |
| foss-omp-full: [foss2023a-serial] | -5.427031944168522e+00 | -1.412203687323199e-13 | -1.726410375700732e-02 | PASS |
| foss-mpi-opt-full: [foss2023a-mpi] | -5.427031944168551e+00 | -1.705302565824240e-13 | -2.084721963110318e-02 | PASS |
| foss-mpi-full: [foss2023a-mpi] | -5.427031944168551e+00 | -1.705302565824240e-13 | -2.084721963110318e-02 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | -5.427031944168561e+00 | -1.811883976188255e-13 | -2.215017085804713e-02 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | -5.427031944168561e+00 | -1.811883976188255e-13 | -2.215017085804713e-02 | PASS |
| cuda-serial: [foss2022a-cuda-mpi] | -5.427031944168559e+00 | -1.785238623597252e-13 | -2.182443305131115e-02 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -5.427031944168539e+00 | -1.589839371263224e-13 | -1.943568913524724e-02 | PASS |
| foss-mpi-debug: [foss2023a-mpi] | -5.427031944168551e+00 | -1.705302565824240e-13 | -2.084721963110318e-02 | PASS |
| foss-mpi-min: [foss2023a-mpi] | -5.427031944168561e+00 | -1.811883976188255e-13 | -2.215017085804713e-02 | PASS |
| foss-mpi-min: [foss2022a-mpi] | -5.427031944168561e+00 | -1.811883976188255e-13 | -2.215017085804713e-02 | PASS |
| foss-mpi-omp-full: [foss2023a-mpi] | -5.427031944168519e+00 | -1.385558334732195e-13 | -1.693836595027134e-02 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -5.427031944168505e+00 | -1.243449787580175e-13 | -1.520109764767941e-02 | PASS |
| cuda-mpi-omp: [foss2022a-cuda-mpi] | -5.427031944168519e+00 | -1.385558334732195e-13 | -1.693836595027134e-02 | PASS |