Match comparison for Total energy (match type 22772)

Commits > Commit b1773e3237a9e3fe1d68ecd7146c17ebbd95a961 > Input 08-benzene_supercell.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.707744601000000e+01 1.850000000000000e-07 -3.707744601000002e+01 1.421085471520200e-14 -3.707744601000000e+01 0.000000000000000e+00 PASS
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Detailed information

Reference: -37.077446009999996, precision: 0.000000185
Run Value Difference Relative difference Status
GCI_foss_min_autotools: [foss2023a-serial] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_foss_opt_autotools: [foss2023a-serial] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
cmake_foss_2022a_full_serial -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_foss_autotools: [foss2022a-serial] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_foss_autotools: [foss2023b-serial] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
spack_foss-2023a_serial_min -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
spack_foss-2022a_serial_min -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
spack_foss-2022a_serial -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
spack_foss-2022a_ppc -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_intel_omp_autotools: [intel2022a-serial] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
spack_foss-2023a_serial -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
cmake_foss_2022a_min_mpi -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_foss-cmake: [foss2022a-serial, foss-min] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_foss_mpi_min_autotools: [foss2022a-mpi] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_foss_debug_autotools: [foss2023a-serial] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
spack_foss-2022a_mpi_min -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
spack_foss-2023a_mpi_min -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_foss_mpi_autotools: [foss2022a-mpi] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_foss_ppc_autotools: [foss2022a-serial] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
cmake_foss_2022a_full_mpi -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
cmake_foss_2022a_min_serial -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
spack_foss-2023a_mpi_opt -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
spack_foss-2023a_serial_debug -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
spack_foss-2022a_mpi -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
spack_foss-2023a_mpi -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_foss_min_autotools: [foss2023b-serial] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
spack_foss-2023a_mpi_debug -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
spack_foss-2023a_mpi_omp -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_foss_autotools: [foss2023a-serial] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_foss_min_autotools: [foss2022a-serial] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
spack_foss-2022a_cuda_mpi_omp -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_intel_autotools: [intel2023a-serial] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_foss_mpi_autotools: [foss2023a-mpi] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
spack_foss-2023a_serial_opt -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_foss_mpi_min_autotools: [foss2023a-mpi] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_foss_omp_autotools: [foss2023a-serial] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
spack_foss-2023a_serial_omp -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
spack_foss-2023b_serial -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
spack_intel-2023a_serial -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
spack_intel-2022a_serial_omp -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_intel_omp_autotools: [intel2023a-serial] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
spack_intel-2023a_serial_omp -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_foss_cuda_autotools: [foss2022a-cuda-mpi] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_intel_mpi_autotools: [intel2023a-mpi] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
spack_intel-2023a_impi -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_foss-cmake: [foss2023a-mpi, foss-min-mpi] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_foss-cmake: [foss2023a-mpi, foss-full-mpi] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
spack_intel-2022a_impi_omp -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
spack_foss-2022a_cuda_serial -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
spack_foss-2023a_valgrind -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS
GCI_foss_valgrind_autotools: [foss2023a-serial] -3.707744601000000e+01 -7.105427357601002e-15 -3.840771544649190e-08 PASS