Match comparison for External energy (match type 29812)

Commits > Commit d48128afc066bfe2b1bb5979f9ee62249e46c834 > Input 22-vdw_d3_stress.01-Be_hpc.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.648353308000000e+01 8.250000000000000e-07 -2.648353334000000e+01 1.353390802261761e-07 -2.648353317500000e+01 2.749999996609631e-07 PASS

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Detailed information

Reference: -26.48353308, precision: 0.000000825
Run Value Difference Relative difference Status
cmake_foss_2022a_full_serial -2.648353337000000e+01 -2.899999991257118e-07 -3.515151504554083e-01 PASS
cmake_foss_2022a_full_mpi -2.648353337000000e+01 -2.899999991257118e-07 -3.515151504554083e-01 PASS
cmake_foss_2022a_min_serial -2.648353337000000e+01 -2.899999991257118e-07 -3.515151504554083e-01 PASS
cmake_foss_2022a_min_mpi -2.648353337000000e+01 -2.899999991257118e-07 -3.515151504554083e-01 PASS
spack_foss-2022a_serial_min -2.648353337000000e+01 -2.899999991257118e-07 -3.515151504554083e-01 PASS
spack_foss-2022a_serial -2.648353337000000e+01 -2.899999991257118e-07 -3.515151504554083e-01 PASS
spack_foss-2022a_mpi_min -2.648353337000000e+01 -2.899999991257118e-07 -3.515151504554083e-01 PASS
spack_foss-2022a_mpi -2.648353337000000e+01 -2.899999991257118e-07 -3.515151504554083e-01 PASS
spack_foss-2023a_mpi_min -2.648353337000000e+01 -2.899999991257118e-07 -3.515151504554083e-01 PASS
spack_foss-2023a_mpi -2.648353337000000e+01 -2.899999991257118e-07 -3.515151504554083e-01 PASS
spack_foss-2023a_serial -2.648353337000000e+01 -2.899999991257118e-07 -3.515151504554083e-01 PASS
spack_foss-2023a_mpi_opt -2.648353337000000e+01 -2.899999991257118e-07 -3.515151504554083e-01 PASS
spack_foss-2023a_serial_min -2.648353337000000e+01 -2.899999991257118e-07 -3.515151504554083e-01 PASS
spack_foss-2023a_serial_opt -2.648353337000000e+01 -2.899999991257118e-07 -3.515151504554083e-01 PASS
spack_foss-2023a_serial_omp -2.648353337000000e+01 -2.899999991257118e-07 -3.515151504554083e-01 PASS
spack_foss-2023a_mpi_omp -2.648353337000000e+01 -2.899999991257118e-07 -3.515151504554083e-01 PASS
spack_foss-2023b_serial -2.648353337000000e+01 -2.899999991257118e-07 -3.515151504554083e-01 PASS
spack_intel-2022a_serial_omp -2.648353345000000e+01 -3.699999986395142e-07 -4.484848468357747e-01 PASS
spack_intel-2023a_serial -2.648353290000000e+01 1.800000006824121e-07 2.181818190089843e-01 PASS
spack_intel-2023a_serial_omp -2.648353345000000e+01 -3.699999986395142e-07 -4.484848468357747e-01 PASS
spack_intel-2023a_impi -2.648353290000000e+01 1.800000006824121e-07 2.181818190089843e-01 PASS
spack_foss-2022a_cuda_mpi_omp -2.648353336000000e+01 -2.799999982983081e-07 -3.393939373312825e-01 PASS
spack_foss-2022a_cuda_serial -2.648353336000000e+01 -2.799999982983081e-07 -3.393939373312825e-01 PASS
spack_intel-2022a_impi_omp -2.648353345000000e+01 -3.699999986395142e-07 -4.484848468357747e-01 PASS