Match comparison for External energy (match type 29752)

Commits > Commit 119356330ffc33ec037b7259f31bc868121af1f1 > Input 10-fullerene.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-8.092408370489999e+03 4.350000000000000e-07 -8.092408370613125e+03 1.951832259137257e-07 -8.092408370609999e+03 3.000000106112566e-07 PASS

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Detailed information

Reference: -8092.4083704899995, precision: 0.000000435
Run Value Difference Relative difference Status
spack_foss-2022a_serial_min -8.092408370310000e+03 1.799999154172838e-07 4.137929090052501e-01 PASS
spack_foss-2023a_serial_min -8.092408370310000e+03 1.799999154172838e-07 4.137929090052501e-01 PASS
spack_foss-2022a_serial_opt -8.092408370740000e+03 -2.500000846339390e-07 -5.747128382389401e-01 PASS
spack_foss-2022a_serial -8.092408370310000e+03 1.799999154172838e-07 4.137929090052501e-01 PASS
spack_foss-2022a_ppc -8.092408370810000e+03 -3.200002538505942e-07 -7.356327674726302e-01 PASS
spack_foss-2022a_mpi_min -8.092408370650000e+03 -1.600001269252971e-07 -3.678163837363151e-01 PASS
spack_foss-2023a_mpi_min -8.092408370650000e+03 -1.600001269252971e-07 -3.678163837363151e-01 PASS
spack_foss-2022a_mpi_opt -8.092408370650000e+03 -1.600001269252971e-07 -3.678163837363151e-01 PASS
spack_foss-2022a_serial_debug -8.092408370310000e+03 1.799999154172838e-07 4.137929090052501e-01 PASS
spack_intel-2022a_serial_omp -8.092408370650000e+03 -1.600001269252971e-07 -3.678163837363151e-01 PASS
spack_foss-2022a_mpi -8.092408370650000e+03 -1.600001269252971e-07 -3.678163837363151e-01 PASS
spack_intel-2023a_impi -8.092408370910000e+03 -4.200001058052294e-07 -9.655174846097228e-01 PASS
spack_foss-2022a_mpi_debug -8.092408370650000e+03 -1.600001269252971e-07 -3.678163837363151e-01 PASS
spack_foss-2022a_cuda_serial -8.092408370910000e+03 -4.200001058052294e-07 -9.655174846097228e-01 PASS
spack_foss-2022a_cuda_mpi_omp -8.092408370650000e+03 -1.600001269252971e-07 -3.678163837363151e-01 PASS
spack_intel-2022a_impi_omp -8.092408370650000e+03 -1.600001269252971e-07 -3.678163837363151e-01 PASS