Match comparison for Kinetic energy (match type 30073)

Commits > Commit dd0acda4415b0ab64c529ca4a26922f9782edb94 > Input 10-fullerene.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
2.086213890000000e+02 1.040000000000000e-05 2.086213890025926e+02 3.864296122547043e-08 2.086213889350000e+02 9.499999009676685e-08 PASS
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Detailed information

Reference: 208.621389, precision: 0.0000104
Run Value Difference Relative difference Status
cmake_foss_2022a_full_serial 2.086213890200000e+02 2.000001586566214e-08 1.923078448621359e-03 PASS
spack_foss-2022a_ppc 2.086213890200000e+02 2.000001586566214e-08 1.923078448621359e-03 PASS
cmake_foss_2022a_min_serial 2.086213890200000e+02 2.000001586566214e-08 1.923078448621359e-03 PASS
cmake_foss_2022a_min_mpi 2.086213888400000e+02 -1.599999848167499e-07 -1.538461392468749e-02 PASS
cmake_foss_2022a_full_mpi 2.086213890300000e+02 2.999999537678377e-08 2.884614940075363e-03 PASS
spack_foss-2022a_mpi_min 2.086213890200000e+02 2.000001586566214e-08 1.923078448621359e-03 PASS
spack_foss-2022a_mpi 2.086213890200000e+02 2.000001586566214e-08 1.923078448621359e-03 PASS
spack_foss-2022a_serial 2.086213890000000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial_min 2.086213890000000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_mpi 2.086213890200000e+02 2.000001586566214e-08 1.923078448621359e-03 PASS
spack_foss-2023a_mpi_min 2.086213890200000e+02 2.000001586566214e-08 1.923078448621359e-03 PASS
spack_foss-2023a_serial_min 2.086213890000000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial 2.086213890000000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_mpi_opt 2.086213890100000e+02 1.000000793283107e-08 9.615392243106796e-04 PASS
spack_foss-2023a_mpi_debug 2.086213890100000e+02 1.000000793283107e-08 9.615392243106796e-04 PASS
spack_foss-2023a_serial_opt 2.086213890200000e+02 2.000001586566214e-08 1.923078448621359e-03 PASS
spack_foss-2023b_serial 2.086213890000000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial_debug 2.086213890000000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial_omp 2.086213890200000e+02 2.000001586566214e-08 1.923078448621359e-03 PASS
spack_intel-2022a_serial_omp 2.086213889100000e+02 -8.999998613035132e-08 -8.653844820226088e-03 PASS
spack_foss-2023a_mpi_omp 2.086213890200000e+02 2.000001586566214e-08 1.923078448621359e-03 PASS
spack_intel-2023a_serial 2.086213889900000e+02 -9.999979511121637e-09 -9.615364914540035e-04 PASS
spack_intel-2023a_impi 2.086213890200000e+02 2.000001586566214e-08 1.923078448621359e-03 PASS
spack_foss-2022a_cuda_mpi_omp 2.086213890200000e+02 2.000001586566214e-08 1.923078448621359e-03 PASS
spack_intel-2023a_serial_omp 2.086213890000000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2022a_impi_omp 2.086213890200000e+02 2.000001586566214e-08 1.923078448621359e-03 PASS
spack_foss-2022a_cuda_serial 2.086213890200000e+02 2.000001586566214e-08 1.923078448621359e-03 PASS