Match comparison for Hartree energy (match type 3414)

Commits > Commit 32c00845502bbc3ac64555e3c727792a7ab72a6a > Input 11-isotopes.01-deuterium.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
2.955485500000000e-01 3.000000000000000e-05 2.955576922033898e-01 2.513965588918278e-07 2.955572600000000e-01 5.000000000143778e-07 PASS

Checks for this match

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Detailed information

Reference: 0.29554855, precision: 0.00003
Run Value Difference Relative difference Status
GCI_foss_ppc_autotools: [foss2022a-serial] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
cmake_foss_2022a_full_serial 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
spack_foss-2022a_ppc 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
spack_foss-2023a_serial_opt 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
cmake_foss_2022a_min_serial 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
cmake_foss_2022a_min_mpi 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
cmake_foss_2022a_full_mpi 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
spack_foss-2022a_mpi 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
spack_foss-2022a_mpi_min 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
spack_foss-2022a_serial 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_foss_min_autotools: [foss2022a-serial] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_foss_min_autotools: [foss2023a-serial] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
spack_foss-2022a_serial_min 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
spack_foss-2023a_serial 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
spack_foss-2023a_mpi_min 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
spack_foss-2023a_mpi 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
spack_foss-2023a_serial_min 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
spack_foss-2023a_mpi_opt 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_foss_min_autotools: [foss2023b-serial] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
spack_foss-2023a_serial_debug 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
spack_foss-2023b_serial 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
spack_foss-2023a_serial_omp 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_foss_omp_autotools: [foss2023a-serial] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
spack_foss-2023a_mpi_debug 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_foss_autotools: [foss2022a-serial] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_foss_opt_autotools: [foss2023a-serial] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_foss_autotools: [foss2023a-serial] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
spack_intel-2022a_serial_omp 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_foss_autotools: [foss2023b-serial] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
spack_foss-2023a_mpi_omp 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
spack_intel-2023a_serial 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_intel_autotools: [intel2023a-serial] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_intel_omp_autotools: [intel2022a-serial] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
spack_intel-2023a_impi 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_intel_omp_autotools: [intel2023a-serial] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_foss_debug_autotools: [foss2023a-serial] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_foss-cmake: [foss2022a-serial, foss-min] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_intel_mpi_autotools: [intel2023a-mpi] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_foss_mpi_min_autotools: [foss2022a-mpi] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_foss_mpi_min_autotools: [foss2023a-mpi] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_foss_mpi_autotools: [foss2022a-mpi] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_foss-cmake: [foss2023a-mpi, foss-min-mpi] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_foss_mpi_autotools: [foss2023a-mpi] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_foss-cmake: [foss2023a-mpi, foss-full-mpi] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
spack_intel-2023a_serial_omp 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
spack_intel-2022a_impi_omp 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
spack_foss-2022a_cuda_mpi_omp 2.955567600000000e-01 8.209999999952977e-06 2.736666666650993e-01 PASS
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
spack_foss-2023a_valgrind 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
spack_foss-2022a_cuda_serial 2.955567600000000e-01 8.209999999952977e-06 2.736666666650993e-01 PASS
GCI_foss_cuda_autotools: [foss2022a-cuda-mpi] 2.955567600000000e-01 8.209999999952977e-06 2.736666666650993e-01 PASS
GCI_foss_valgrind_autotools: [foss2023a-serial] 2.955577600000000e-01 9.209999999981733e-06 3.069999999993911e-01 PASS
GCI_foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] 2.955567600000000e-01 8.209999999952977e-06 2.736666666650993e-01 PASS