Match comparison for Ion-ion energy (match type 29583)

Commits > Commit 8f782d5cf55620fdc67b764848371cb8de44e683 > Input 07-mgga.05-br89_primitive.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.980012852000000e+01 9.900000000000000e-08 -1.980012852000000e+01 0.000000000000000e+00 -1.980012852000000e+01 0.000000000000000e+00 PASS
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Detailed information

Reference: -19.800128519999998, precision: 0.000000099
Run Value Difference Relative difference Status
spack_foss-2022a_serial_min -1.980012852000000e+01 -3.552713678800501e-15 -3.588599675556062e-08 PASS
spack_foss-2022a_serial -1.980012852000000e+01 -3.552713678800501e-15 -3.588599675556062e-08 PASS
cmake_foss_2022a_full_serial -1.980012852000000e+01 -3.552713678800501e-15 -3.588599675556062e-08 PASS
cmake_foss_2022a_min_serial -1.980012852000000e+01 -3.552713678800501e-15 -3.588599675556062e-08 PASS
spack_foss-2022a_ppc -1.980012852000000e+01 -3.552713678800501e-15 -3.588599675556062e-08 PASS
spack_foss-2023a_mpi_min -1.980012852000000e+01 -3.552713678800501e-15 -3.588599675556062e-08 PASS
cmake_foss_2022a_min_mpi -1.980012852000000e+01 -3.552713678800501e-15 -3.588599675556062e-08 PASS
cmake_foss_2022a_full_mpi -1.980012852000000e+01 -3.552713678800501e-15 -3.588599675556062e-08 PASS
spack_foss-2022a_cuda_serial -1.980012852000000e+01 -3.552713678800501e-15 -3.588599675556062e-08 PASS
spack_foss-2023a_mpi -1.980012852000000e+01 -3.552713678800501e-15 -3.588599675556062e-08 PASS
spack_foss-2022a_mpi_min -1.980012852000000e+01 -3.552713678800501e-15 -3.588599675556062e-08 PASS
spack_foss-2022a_mpi -1.980012852000000e+01 -3.552713678800501e-15 -3.588599675556062e-08 PASS
spack_foss-2023a_mpi_debug -1.980012852000000e+01 -3.552713678800501e-15 -3.588599675556062e-08 PASS
spack_foss-2023a_serial -1.980012852000000e+01 -3.552713678800501e-15 -3.588599675556062e-08 PASS
spack_foss-2023a_mpi_opt -1.980012852000000e+01 -3.552713678800501e-15 -3.588599675556062e-08 PASS
spack_foss-2023a_serial_min -1.980012852000000e+01 -3.552713678800501e-15 -3.588599675556062e-08 PASS
spack_foss-2023a_serial_debug -1.980012852000000e+01 -3.552713678800501e-15 -3.588599675556062e-08 PASS
spack_foss-2023a_mpi_omp -1.980012852000000e+01 -3.552713678800501e-15 -3.588599675556062e-08 PASS
spack_foss-2023a_serial_opt -1.980012852000000e+01 -3.552713678800501e-15 -3.588599675556062e-08 PASS
spack_foss-2023b_serial -1.980012852000000e+01 -3.552713678800501e-15 -3.588599675556062e-08 PASS
spack_foss-2023a_serial_omp -1.980012852000000e+01 -3.552713678800501e-15 -3.588599675556062e-08 PASS
spack_intel-2023a_serial -1.980012852000000e+01 -3.552713678800501e-15 -3.588599675556062e-08 PASS
spack_intel-2022a_serial_omp -1.980012852000000e+01 -3.552713678800501e-15 -3.588599675556062e-08 PASS
spack_intel-2023a_serial_omp -1.980012852000000e+01 -3.552713678800501e-15 -3.588599675556062e-08 PASS
spack_intel-2023a_impi -1.980012852000000e+01 -3.552713678800501e-15 -3.588599675556062e-08 PASS
spack_intel-2022a_impi_omp -1.980012852000000e+01 -3.552713678800501e-15 -3.588599675556062e-08 PASS