Match comparison for Hartree energy (match type 20919)

Commits > Commit 32c00845502bbc3ac64555e3c727792a7ab72a6a > Input 05-forces.01-Na2.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
4.632551500000000e-01 2.320000000000000e-07 4.632551499999999e-01 5.551115123125783e-17 4.632551500000000e-01 0.000000000000000e+00 PASS
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Detailed information

Reference: 0.46325515, precision: 0.000000232
Run Value Difference Relative difference Status
GCI_foss_ppc_autotools: [foss2022a-serial] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
cmake_foss_2022a_full_serial 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_ppc 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
cmake_foss_2022a_min_serial 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial_opt 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
cmake_foss_2022a_min_mpi 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
cmake_foss_2022a_full_mpi 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_mpi 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_mpi_min 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_min_autotools: [foss2022a-serial] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_min_autotools: [foss2023a-serial] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial_min 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_mpi_min 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_mpi 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial_min 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_mpi_opt 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_min_autotools: [foss2023b-serial] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial_debug 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023b_serial 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial_omp 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_omp_autotools: [foss2023a-serial] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_mpi_debug 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_autotools: [foss2022a-serial] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_opt_autotools: [foss2023a-serial] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_autotools: [foss2023a-serial] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2022a_serial_omp 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_autotools: [foss2023b-serial] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_mpi_omp 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2023a_serial 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_intel_autotools: [intel2023a-serial] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2023a_impi 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_intel_omp_autotools: [intel2022a-serial] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_intel_omp_autotools: [intel2023a-serial] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_debug_autotools: [foss2023a-serial] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss-cmake: [foss2022a-serial, foss-min] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_intel_mpi_autotools: [intel2023a-mpi] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_mpi_min_autotools: [foss2022a-mpi] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_mpi_min_autotools: [foss2023a-mpi] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_mpi_autotools: [foss2022a-mpi] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss-cmake: [foss2023a-mpi, foss-min-mpi] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_mpi_autotools: [foss2023a-mpi] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss-cmake: [foss2023a-mpi, foss-full-mpi] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2023a_serial_omp 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2022a_impi_omp 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_cuda_mpi_omp 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_valgrind 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_cuda_serial 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_cuda_autotools: [foss2022a-cuda-mpi] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_valgrind_autotools: [foss2023a-serial] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] 4.632551500000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS