Match comparison for Energy [step 3] (match type 23963)

Commits > Commit 4eed2c655b9f478fca43a397c5feb863f7436add > Input 10-bomd.03-td_restart.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.058220089493070e+01 8.400000000000001e-09 -1.058220089625460e+01 6.911976450918764e-09 -1.058220089488793e+01 7.341549590478280e-09 PASS

Checks for this match

  • MPI builders have different values.
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Detailed information

Reference: -10.5822008949307, precision: 0.0000000084
Run Value Difference Relative difference Status
eb_foss-2022a_ppc -1.058220090153281e+01 -6.602107305297977e-09 -7.859651553926162e-01 PASS
cmake_foss_2022a_full_serial -1.058220090186361e+01 -6.932907581358450e-09 -8.253461406379106e-01 PASS
cmake_foss_2022a_min_serial -1.058220090186361e+01 -6.932907581358450e-09 -8.253461406379106e-01 PASS
cmake_foss_2022a_full_mpi -1.058220088764195e+01 7.288747383427108e-09 8.677080218365604e-01 PASS
eb_fosscuda-2022a -1.058220090189977e+01 -6.969070653894960e-09 -8.296512683208285e-01 PASS
cmake_foss_2022a_min_mpi -1.058220088755002e+01 7.380679178936589e-09 8.786522832067367e-01 PASS
eb_foss-2022a_debug -1.058220090179187e+01 -6.861165857685592e-09 -8.168054592482846e-01 PASS
eb_foss-2022b_libxc6 -1.058220090188640e+01 -6.955700015964794e-09 -8.280595257100944e-01 PASS
eb_intel-2022a -1.058220090189101e+01 -6.960311438319877e-09 -8.286085045618901e-01 PASS
eb_foss-2022b_libxc6_mpi -1.058220088777416e+01 7.156543802011583e-09 8.519695002394742e-01 PASS
intel-2022b -1.058220090189101e+01 -6.960311438319877e-09 -8.286085045618901e-01 PASS
eb_intel-2022a_omp -1.058220090222948e+01 -7.298782023212880e-09 -8.689026218110570e-01 PASS
eb_foss-2022a_mpi_debug -1.058220088832721e+01 6.603489310919031e-09 7.861296798713131e-01 PASS
eb_intel-2022a_impi -1.058220088779931e+01 7.131387036451997e-09 8.489746471966663e-01 PASS
spack_foss-2022a_serial -1.058220090195487e+01 -7.024171466696316e-09 -8.362108888924186e-01 PASS
spack_foss-2022a_mpi -1.058220088755713e+01 7.373566646151630e-09 8.778055531132892e-01 PASS
spack_foss-2022a_cuda_mpi_omp -1.058220088754638e+01 7.384317157743681e-09 8.790853759218666e-01 PASS
spack_foss-2022a_serial_min -1.058220090195487e+01 -7.024171466696316e-09 -8.362108888924186e-01 PASS
intel-2022b_impi -1.058220088779931e+01 7.131387036451997e-09 8.489746471966663e-01 PASS
spack_foss-2022a_serial_debug -1.058220090195487e+01 -7.024171466696316e-09 -8.362108888924186e-01 PASS
spack_foss-2022a_serial_omp -1.058220090200415e+01 -7.073449381778119e-09 -8.420773073545379e-01 PASS
spack_foss-2022a_serial_opt -1.058220090186361e+01 -6.932907581358450e-09 -8.253461406379106e-01 PASS
spack_foss-2022a_mpi_omp -1.058220088789811e+01 7.032594950828752e-09 8.372136846224704e-01 PASS
eb_intel-2022a_omp_impi -1.058220088802775e+01 6.902951099618804e-09 8.217798928117622e-01 PASS
eb_foss-2022a_valgrind -1.058220090186164e+01 -6.930942930694073e-09 -8.251122536540563e-01 PASS