Match comparison for Energy [step 1] (match type 17474)

Commits > Commit b6caf805fea115365f1246dd8a44b3bc3b7dd03a > Input 10-bomd.02-td.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.058171294371180e+01 1.110000000000000e-09 -1.058171294377139e+01 1.011527313146652e-09 -1.058171294371179e+01 1.013289896434344e-09 PASS

Checks for this match

  • MPI builders have different values.
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Detailed information

Reference: -10.5817129437118, precision: 0.00000000111
Run Value Difference Relative difference Status
spack_foss-2022a_serial_min -1.058171294472507e+01 -1.013269468330691e-09 -9.128553768744962e-01 PASS
spack_foss-2023a_serial_min -1.058171294472507e+01 -1.013269468330691e-09 -9.128553768744962e-01 PASS
spack_foss-2022a_serial_opt -1.058171294472507e+01 -1.013267691973851e-09 -9.128537765530192e-01 PASS
spack_foss-2022a_serial -1.058171294472507e+01 -1.013269468330691e-09 -9.128553768744962e-01 PASS
spack_foss-2022a_ppc -1.058171294472506e+01 -1.013257033832815e-09 -9.128441746241577e-01 PASS
spack_foss-2022a_mpi_min -1.058171294269850e+01 1.013296113683282e-09 9.128793816966503e-01 PASS
spack_foss-2023a_mpi_min -1.058171294269850e+01 1.013296113683282e-09 9.128793816966503e-01 PASS
spack_foss-2022a_serial_debug -1.058171294472507e+01 -1.013269468330691e-09 -9.128553768744962e-01 PASS
spack_foss-2022a_mpi_opt -1.058171294269850e+01 1.013297890040121e-09 9.128809820181272e-01 PASS
spack_intel-2022a_serial_omp -1.058171294472508e+01 -1.013281902828567e-09 -9.128665791248347e-01 PASS
spack_foss-2022a_mpi -1.058171294269850e+01 1.013297890040121e-09 9.128809820181272e-01 PASS
spack_foss-2022a_cuda_serial -1.058171294472508e+01 -1.013276573758048e-09 -9.128617781604039e-01 PASS
spack_intel-2023a_impi -1.058171294269852e+01 1.013283679185406e-09 9.128681794463117e-01 PASS
spack_foss-2022a_mpi_debug -1.058171294269850e+01 1.013297890040121e-09 9.128809820181272e-01 PASS
spack_foss-2022a_cuda_mpi_omp -1.058171294269850e+01 1.013296113683282e-09 9.128793816966503e-01 PASS
spack_intel-2022a_impi_omp -1.058171294269851e+01 1.013290784612764e-09 9.128745807322195e-01 PASS
spack_foss-2022a_valgrind -1.058171294472506e+01 -1.013262362903333e-09 -9.128489755885885e-01 PASS