Match comparison for Total energy (match type 26854)

Commits > Commit 3f59639a2c09960e9ce8b923e2789a20396f5ecf > Input 10-vdw_d3_dna.02-gs_d3.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.028070189600000e+02 1.510000000000000e-07 -3.028070189600000e+02 0.000000000000000e+00 -3.028070189600000e+02 0.000000000000000e+00 PASS
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Detailed information

Reference: -302.80701896, precision: 0.000000151
Run Value Difference Relative difference Status
spack_foss-2022a_serial_min -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial_min -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
cmake_foss_2022a_full_serial -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_ppc -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_mpi_min -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_mpi_min -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
cmake_foss_2022a_full_mpi -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial_debug -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_mpi_opt -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_mpi -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_mpi -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_cuda_serial -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
cmake_foss_2022a_min_mpi -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_mpi_debug -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_mpi_omp -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_cuda_mpi_omp -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
cmake_foss_2022a_min_serial -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial_opt -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023b_serial -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial_omp -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2023a_serial -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2022a_serial_omp -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2023a_serial_omp -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2023a_impi -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2022a_impi_omp -3.028070189600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS