Match comparison for Total energy (match type 15256)

Commits > Commit d6f4833c99197407842d58e82c91c418d3d73b88 > Input 03-He-Hartree-Fock.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.947939240000000e+00 1.470000000000000e-07 -2.947939240000000e+00 4.440892098500626e-16 -2.947939240000000e+00 0.000000000000000e+00 PASS
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Detailed information

Reference: -2.9479392399999997, precision: 0.000000147
Run Value Difference Relative difference Status
spack_foss-2022a_serial_min -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
spack_foss-2023a_serial_min -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
spack_foss-2023a_serial -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
spack_foss-2022a_serial -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
spack_foss-2023a_serial_opt -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
spack_foss-2023b_serial -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
spack_foss-2022a_ppc -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
spack_foss-2023a_mpi_min -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
spack_foss-2022a_mpi_min -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
spack_foss-2023a_serial_debug -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
spack_foss-2023a_serial_omp -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
spack_foss-2023a_mpi_opt -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
spack_foss-2022a_mpi -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
spack_foss-2023a_mpi -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
cmake_foss_2022a_full_mpi -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
spack_foss-2022a_cuda_serial -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
spack_foss-2023a_mpi_debug -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
spack_foss-2022a_cuda_mpi_omp -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
spack_foss-2023a_mpi_omp -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
cmake_foss_2022a_min_serial -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
cmake_foss_2022a_full_serial -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
cmake_foss_2022a_min_mpi -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
spack_intel-2023a_serial -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
spack_intel-2022a_serial_omp -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
spack_intel-2023a_serial_omp -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
spack_intel-2023a_impi -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
spack_intel-2022a_impi_omp -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS
spack_foss-2023a_valgrind -2.947939240000000e+00 -4.440892098500626e-16 -3.021015032993623e-09 PASS