Match comparison for Total energy (match type 23486)

Commits > Commit daa93de2f371acc02c8ba320d7b5759725cfd1f4 > Input 10-fullerene.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.245061313400000e+02 3.740000000000000e-07 -3.245061312800000e+02 9.955457140709760e-08 -3.245061311600000e+02 1.600000132384594e-07 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: -324.50613134, precision: 0.000000374
Run Value Difference Relative difference Status
cmake_foss_2022a_full_serial -3.245061312900000e+02 5.000003966415534e-08 1.336899456260838e-01 PASS
spack_foss-2022a_serial_min -3.245061310000000e+02 3.400000423425809e-07 9.090910223063660e-01 PASS
foss-2022a_ppc -3.245061313200000e+02 2.000001586566214e-08 5.347597825043352e-02 PASS
spack_foss-2022a_serial_opt -3.245061312900000e+02 5.000003966415534e-08 1.336899456260838e-01 PASS
spack_foss-2022a_serial -3.245061310000000e+02 3.400000423425809e-07 9.090910223063660e-01 PASS
foss-2022a_opt -3.245061313200000e+02 2.000001586566214e-08 5.347597825043352e-02 PASS
intel-2022b -3.245061313200000e+02 2.000001586566214e-08 5.347597825043352e-02 PASS
intel-2022a -3.245061313200000e+02 2.000001586566214e-08 5.347597825043352e-02 PASS
spack_foss-2022a_serial_omp -3.245061313200000e+02 2.000001586566214e-08 5.347597825043352e-02 PASS
cmake_foss_2022a_full_mpi -3.245061313200000e+02 2.000001586566214e-08 5.347597825043352e-02 PASS
spack_foss-2022a_serial_debug -3.245061310000000e+02 3.400000423425809e-07 9.090910223063660e-01 PASS
foss-2022a_omp -3.245061313200000e+02 2.000001586566214e-08 5.347597825043352e-02 PASS
intel-2022a_omp -3.245061312900000e+02 5.000003966415534e-08 1.336899456260838e-01 PASS
intel-2022b_impi -3.245061313200000e+02 2.000001586566214e-08 5.347597825043352e-02 PASS
intel-2022a_impi -3.245061313200000e+02 2.000001586566214e-08 5.347597825043352e-02 PASS
eb_fosscuda-2022a_mpi_omp -3.245061313200000e+02 2.000001586566214e-08 5.347597825043352e-02 PASS
eb_fosscuda-2022a -3.245061313200000e+02 2.000001586566214e-08 5.347597825043352e-02 PASS
cmake_foss_2022a_min_serial -3.245061312900000e+02 5.000003966415534e-08 1.336899456260838e-01 PASS
foss-2022a_mpi_omp -3.245061313200000e+02 2.000001586566214e-08 5.347597825043352e-02 PASS
cmake_foss_2022a_min_mpi -3.245061313200000e+02 2.000001586566214e-08 5.347597825043352e-02 PASS
eb_foss-2022a -3.245061313200000e+02 2.000001586566214e-08 5.347597825043352e-02 PASS
eb_foss-2022b_libxc6 -3.245061313200000e+02 2.000001586566214e-08 5.347597825043352e-02 PASS
eb_foss-2022a_debug -3.245061313200000e+02 2.000001586566214e-08 5.347597825043352e-02 PASS
intel-2022a_omp_impi -3.245061313200000e+02 2.000001586566214e-08 5.347597825043352e-02 PASS
eb_foss-2022a_mpi -3.245061313200000e+02 2.000001586566214e-08 5.347597825043352e-02 PASS
eb_foss-2022b_libxc6_mpi -3.245061313200000e+02 2.000001586566214e-08 5.347597825043352e-02 PASS
eb_foss-2022a_mpi_debug -3.245061313200000e+02 2.000001586566214e-08 5.347597825043352e-02 PASS