Match comparison for Kinetic energy (match type 30285)

Commits > Commit bb686499811dbfe67b92ca3aeb5b2659998636fa > Input 22-vdw_d3_stress.01-Be_hpc.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
1.199237750000000e+01 8.960000000000000e-07 1.199237700732143e+01 5.575279975353452e-07 1.199237750500000e+01 8.149999999318425e-07 PASS
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Detailed information

Reference: 11.9923775, precision: 0.000000896
Run Value Difference Relative difference Status
cmake_foss_2022a_full_serial 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
spack_foss-2022a_serial_min 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
spack_foss-2022a_serial 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
spack_foss-2022a_ppc 1.199237796000000e+01 4.600000007570770e-07 5.133928579878092e-01 PASS
spack_foss-2022a_mpi_min 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
GCI_foss_cuda_autotools: [foss2022a-cuda-mpi] 1.199237719000000e+01 -3.100000007805193e-07 -3.459821437282581e-01 PASS
cmake_foss_2022a_full_mpi 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
spack_foss-2022a_mpi 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
cmake_foss_2022a_min_serial 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
spack_foss-2023a_mpi 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
cmake_foss_2022a_min_mpi 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
GCI_foss-cmake: [foss2022a-serial, foss-min] 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
GCI_foss_opt_autotools: [foss2023a-serial] 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
GCI_intel_autotools: [intel2023a-serial] 1.199237750000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_omp_autotools: [foss2023a-serial] 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
GCI_intel_omp_autotools: [intel2023a-serial] 1.199237832000000e+01 8.200000003455443e-07 9.151785718142236e-01 PASS
GCI_intel_omp_autotools: [intel2022a-serial] 1.199237832000000e+01 8.200000003455443e-07 9.151785718142236e-01 PASS
GCI_intel_mpi_autotools: [intel2023a-mpi] 1.199237750000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_mpi_debug 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
GCI_foss_ppc_autotools: [foss2022a-serial] 1.199237796000000e+01 4.600000007570770e-07 5.133928579878092e-01 PASS
GCI_foss_min_autotools: [foss2022a-serial] 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
GCI_foss_min_autotools: [foss2023a-serial] 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
spack_foss-2023a_mpi_min 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
GCI_foss_min_autotools: [foss2023b-serial] 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
GCI_foss_autotools: [foss2022a-serial] 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
GCI_foss_autotools: [foss2023a-serial] 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
GCI_foss_autotools: [foss2023b-serial] 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
GCI_foss_debug_autotools: [foss2023a-serial] 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
spack_foss-2023a_serial 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
GCI_foss_mpi_min_autotools: [foss2022a-mpi] 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
GCI_foss_mpi_min_autotools: [foss2023a-mpi] 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
GCI_foss_mpi_autotools: [foss2022a-mpi] 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
GCI_foss_mpi_autotools: [foss2023a-mpi] 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
spack_foss-2023a_mpi_opt 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
spack_foss-2023a_serial_debug 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
spack_foss-2023a_serial_min 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
spack_foss-2023a_serial_opt 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
spack_foss-2023a_mpi_omp 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] 1.199237832000000e+01 8.200000003455443e-07 9.151785718142236e-01 PASS
spack_foss-2023b_serial 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
spack_foss-2023a_serial_omp 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
spack_intel-2023a_serial 1.199237750000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2022a_serial_omp 1.199237832000000e+01 8.200000003455443e-07 9.151785718142236e-01 PASS
spack_intel-2023a_serial_omp 1.199237832000000e+01 8.200000003455443e-07 9.151785718142236e-01 PASS
spack_intel-2023a_impi 1.199237750000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2022a_impi_omp 1.199237832000000e+01 8.200000003455443e-07 9.151785718142236e-01 PASS
spack_foss-2022a_cuda_mpi_omp 1.199237719000000e+01 -3.100000007805193e-07 -3.459821437282581e-01 PASS
spack_foss-2023a_valgrind 1.199237740000000e+01 -9.999999939225290e-08 -1.116071421788537e-01 PASS
GCI_foss_valgrind_autotools: [foss2023a-serial] 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
spack_foss-2022a_cuda_serial 1.199237719000000e+01 -3.100000007805193e-07 -3.459821437282581e-01 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] 1.199237669000000e+01 -8.099999995181406e-07 -9.040178566050677e-01 PASS