Match comparison for Energy [step 3] (match type 29797)

Commits > Commit d48128afc066bfe2b1bb5979f9ee62249e46c834 > Input 10-bomd.03-td_restart.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.058220089493070e+01 1.750000000000000e-08 -1.058220089589426e+01 7.029703679864519e-09 -1.058220089504207e+01 7.507894750347077e-09 PASS

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  • MPI builders have different values.
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Detailed information

Reference: -10.5822008949307, precision: 0.0000000175
Run Value Difference Relative difference Status
spack_foss-2022a_ppc -1.058220090241464e+01 -7.483935249297247e-09 -4.276534428169855e-01 PASS
cmake_foss_2022a_full_serial -1.058220090186361e+01 -6.932907581358450e-09 -3.961661475061971e-01 PASS
cmake_foss_2022a_full_mpi -1.058220088764195e+01 7.288747383427108e-09 4.164998504815490e-01 PASS
cmake_foss_2022a_min_serial -1.058220090186361e+01 -6.932907581358450e-09 -3.961661475061971e-01 PASS
cmake_foss_2022a_min_mpi -1.058220088755002e+01 7.380679178936589e-09 4.217530959392336e-01 PASS
spack_foss-2022a_serial_min -1.058220090195487e+01 -7.024171466696316e-09 -4.013812266683609e-01 PASS
spack_foss-2022a_serial -1.058220090195487e+01 -7.024171466696316e-09 -4.013812266683609e-01 PASS
spack_foss-2022a_mpi_min -1.058220088806780e+01 6.862901358317686e-09 3.921657919038677e-01 PASS
spack_foss-2022a_mpi -1.058220088755713e+01 7.373566646151630e-09 4.213466654943788e-01 PASS
spack_foss-2023a_mpi_min -1.058220088806780e+01 6.862901358317686e-09 3.921657919038677e-01 PASS
spack_foss-2023a_mpi -1.058220088755713e+01 7.373566646151630e-09 4.213466654943788e-01 PASS
spack_foss-2023a_serial -1.058220090195487e+01 -7.024171466696316e-09 -4.013812266683609e-01 PASS
spack_foss-2023a_mpi_opt -1.058220088764195e+01 7.288747383427108e-09 4.164998504815490e-01 PASS
spack_foss-2023a_serial_min -1.058220090195487e+01 -7.024171466696316e-09 -4.013812266683609e-01 PASS
spack_foss-2023a_mpi_debug -1.058220088755713e+01 7.373566646151630e-09 4.213466654943788e-01 PASS
spack_foss-2023a_serial_debug -1.058220090195487e+01 -7.024171466696316e-09 -4.013812266683609e-01 PASS
spack_foss-2023a_serial_opt -1.058220090186361e+01 -6.932907581358450e-09 -3.961661475061971e-01 PASS
spack_foss-2023a_serial_omp -1.058220090201460e+01 -7.083899689064310e-09 -4.047942679465320e-01 PASS
spack_foss-2023a_mpi_omp -1.058220088843416e+01 6.496541971046099e-09 3.712309697740628e-01 PASS
spack_foss-2023b_serial -1.058220090195487e+01 -7.024171466696316e-09 -4.013812266683609e-01 PASS
spack_intel-2022a_serial_omp -1.058220090157205e+01 -6.641354133307686e-09 -3.795059504747249e-01 PASS
spack_intel-2023a_serial -1.058220090225274e+01 -7.322038086954308e-09 -4.184021763973890e-01 PASS
spack_intel-2023a_serial_omp -1.058220090157205e+01 -6.641354133307686e-09 -3.795059504747249e-01 PASS
spack_intel-2023a_impi -1.058220088790326e+01 7.027436410567134e-09 4.015677948895505e-01 PASS
spack_foss-2022a_cuda_mpi_omp -1.058220088753418e+01 7.396522505587200e-09 4.226584288906971e-01 PASS
spack_foss-2022a_cuda_serial -1.058220090254997e+01 -7.619266995106955e-09 -4.353866854346831e-01 PASS
spack_intel-2022a_impi_omp -1.058220088787854e+01 7.052163297771585e-09 4.029807598726620e-01 PASS
spack_foss-2023a_valgrind -1.058220090195202e+01 -7.021320413969079e-09 -4.012183093696616e-01 PASS