Match comparison for External energy (match type 26102)

Commits > Commit 26e63ce6623e1d4b39697bebbd513dd45521ca85 > Input 18-TiO2.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.632415143850000e+02 4.830000000000000e-06 -1.632415153737037e+02 1.372689032449553e-06 -1.632415156800000e+02 2.240000000597320e-06 PASS

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Detailed information

Reference: -163.24151438500002, precision: 0.00000483
Run Value Difference Relative difference Status
foss-2022a_ppc -1.632415134400000e+02 9.450000106880907e-07 1.956521761258987e-01 PASS
cmake_foss_2022a_full_serial -1.632415147500000e+02 -3.649999769095302e-07 -7.556935339741826e-02 PASS
cmake_foss_2022a_min_serial -1.632415147500000e+02 -3.649999769095302e-07 -7.556935339741826e-02 PASS
cmake_foss_2022a_full_mpi -1.632415166000000e+02 -2.214999994976097e-06 -4.585921314650304e-01 PASS
cmake_foss_2022a_min_mpi -1.632415150300000e+02 -6.449999716551247e-07 -1.335403668023032e-01 PASS
eb_foss-2022a -1.632415175900000e+02 -3.204999984518508e-06 -6.635610733992771e-01 PASS
eb_foss-2022b_libxc6 -1.632415135400000e+02 8.450000166249083e-07 1.749482436076415e-01 PASS
eb_foss-2022a_debug -1.632415175900000e+02 -3.204999984518508e-06 -6.635610733992771e-01 PASS
eb_foss-2022a_mpi -1.632415179200000e+02 -3.534999990506549e-06 -7.318840560054966e-01 PASS
eb_foss-2022b_libxc6_mpi -1.632415139600000e+02 4.250000245065166e-07 8.799172350031399e-02 PASS
foss-2022a_opt -1.632415175900000e+02 -3.204999984518508e-06 -6.635610733992771e-01 PASS
eb_foss-2022a_mpi_debug -1.632415179200000e+02 -3.534999990506549e-06 -7.318840560054966e-01 PASS
foss-2022a_omp -1.632415136700000e+02 7.150000271849422e-07 1.480331319223483e-01 PASS
intel-2022a -1.632415167000000e+02 -2.314999989039279e-06 -4.792960639832876e-01 PASS
intel-2022b -1.632415167000000e+02 -2.314999989039279e-06 -4.792960639832876e-01 PASS
spack_foss-2022a_serial -1.632415147500000e+02 -3.649999769095302e-07 -7.556935339741826e-02 PASS
intel-2022a_omp -1.632415148400000e+02 -4.549999914615910e-07 -9.420289678293808e-02 PASS
eb_fosscuda-2022a -1.632415153000000e+02 -9.149999868895975e-07 -1.894409910744508e-01 PASS
intel-2022a_impi -1.632415143600000e+02 2.500001983207767e-08 5.175987542873223e-03 PASS
spack_foss-2022a_serial_min -1.632415147500000e+02 -3.649999769095302e-07 -7.556935339741826e-02 PASS
spack_foss-2022a_serial_debug -1.632415147500000e+02 -3.649999769095302e-07 -7.556935339741826e-02 PASS
intel-2022b_impi -1.632415143600000e+02 2.500001983207767e-08 5.175987542873223e-03 PASS
foss-2022a_mpi_omp -1.632415150200000e+02 -6.349999921440030e-07 -1.314699776695658e-01 PASS
spack_foss-2022a_serial_opt -1.632415147500000e+02 -3.649999769095302e-07 -7.556935339741826e-02 PASS
spack_foss-2022a_serial_omp -1.632415143700000e+02 1.500001189924660e-08 3.105592525723934e-03 PASS
eb_fosscuda-2022a_mpi_omp -1.632415150700000e+02 -6.849999749647395e-07 -1.418219409864885e-01 PASS
intel-2022a_omp_impi -1.632415150200000e+02 -6.349999921440030e-07 -1.314699776695658e-01 PASS