Match comparison for Total energy (match type 2073)

Commits > Commit e0b7240ece6c1278a2610f2d337090ca4d2c526d > Input 03-vdw_sternheimer.01-ground_state.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.844783760000000e+00 1.000000000000000e-04 -2.844804580000000e+00 0.000000000000000e+00 -2.844804580000000e+00 0.000000000000000e+00 PASS

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Detailed information

Reference: -2.84478376, precision: 0.0001
Run Value Difference Relative difference Status
spack_foss-2022a_serial_min -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS
spack_foss-2022a_serial -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS
spack_foss-2023a_serial -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS
spack_foss-2022a_ppc -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS
spack_foss-2022a_cuda_serial -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS
spack_foss-2022a_mpi_min -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS
spack_foss-2023a_mpi_min -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS
cmake_foss_2022a_full_mpi -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS
spack_foss-2023a_mpi_opt -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS
spack_foss-2023a_serial_debug -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS
cmake_foss_2022a_full_serial -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS
spack_foss-2022a_mpi -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS
spack_foss-2023a_mpi -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS
cmake_foss_2022a_min_mpi -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS
cmake_foss_2022a_min_serial -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS
spack_foss-2022a_cuda_mpi_omp -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS
spack_foss-2023a_mpi_debug -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS
spack_foss-2023a_mpi_omp -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS
spack_foss-2023a_serial_min -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS
spack_foss-2023a_serial_opt -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS
spack_foss-2023b_serial -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS
spack_foss-2023a_serial_omp -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS
spack_intel-2023a_serial -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS
spack_intel-2022a_serial_omp -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS
spack_intel-2023a_serial_omp -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS
spack_intel-2023a_impi -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS
spack_intel-2022a_impi_omp -2.844804580000000e+00 -2.082000000003248e-05 -2.082000000003248e-01 PASS