Match comparison for Energy [step 10] (match type 14079)

Commits > Commit b2c9b4a951ad3e3faeb99c2d543d652f634c0371 > Input 05-time_propagation.05-td_md.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.791001520298000e+01 1.900000000000000e-10 -3.791001520298101e+01 8.499140325645124e-14 -3.791001520298100e+01 1.385558334732195e-13 PASS
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Detailed information

Reference: -37.91001520298, precision: 0.00000000019
Run Value Difference Relative difference Status
foss-2022a_ppc -3.791001520298099e+01 -9.876544027065393e-13 -5.198181066876523e-03 PASS
spack_foss-2022a_serial_min -3.791001520298110e+01 -1.101341240428155e-12 -5.796532844358712e-03 PASS
spack_foss-2022a_serial -3.791001520298110e+01 -1.101341240428155e-12 -5.796532844358712e-03 PASS
foss-2022a_opt -3.791001520298114e+01 -1.136868377216160e-12 -5.983517774821897e-03 PASS
intel-2022b -3.791001520298099e+01 -9.876544027065393e-13 -5.198181066876523e-03 PASS
intel-2022a -3.791001520298099e+01 -9.876544027065393e-13 -5.198181066876523e-03 PASS
spack_foss-2022a_serial_omp -3.791001520298099e+01 -9.876544027065393e-13 -5.198181066876523e-03 PASS
cmake_foss_2022a_full_serial -3.791001520298113e+01 -1.129762949858559e-12 -5.946120788729260e-03 PASS
spack_foss-2022a_serial_debug -3.791001520298110e+01 -1.101341240428155e-12 -5.796532844358712e-03 PASS
foss-2022a_omp -3.791001520298096e+01 -9.592326932761353e-13 -5.048593122505976e-03 PASS
cmake_foss_2022a_full_mpi -3.791001520298096e+01 -9.663381206337363e-13 -5.085990108598612e-03 PASS
intel-2022a_omp -3.791001520298092e+01 -9.166001291305292e-13 -4.824211205950154e-03 PASS
intel-2022b_impi -3.791001520298087e+01 -8.739675649849232e-13 -4.599829289394333e-03 PASS
intel-2022a_impi -3.791001520298087e+01 -8.739675649849232e-13 -4.599829289394333e-03 PASS
cmake_foss_2022a_min_mpi -3.791001520298095e+01 -9.521272659185342e-13 -5.011196136413339e-03 PASS
cmake_foss_2022a_min_serial -3.791001520298113e+01 -1.129762949858559e-12 -5.946120788729260e-03 PASS
foss-2022a_mpi_omp -3.791001520298099e+01 -9.947598300641403e-13 -5.235578052969160e-03 PASS
eb_fosscuda-2022a_mpi_omp -3.791001520298099e+01 -9.876544027065393e-13 -5.198181066876523e-03 PASS
eb_foss-2022a -3.791001520298113e+01 -1.129762949858559e-12 -5.946120788729260e-03 PASS
eb_foss-2022b_libxc6 -3.791001520298110e+01 -1.101341240428155e-12 -5.796532844358712e-03 PASS
eb_foss-2022a_debug -3.791001520298113e+01 -1.129762949858559e-12 -5.946120788729260e-03 PASS
intel-2022a_omp_impi -3.791001520298086e+01 -8.597567102697212e-13 -4.525035317209060e-03 PASS
eb_foss-2022a_mpi -3.791001520298101e+01 -1.016076112136943e-12 -5.347769011247070e-03 PASS
eb_foss-2022b_libxc6_mpi -3.791001520298100e+01 -1.001865257421741e-12 -5.272975039061796e-03 PASS
eb_foss-2022a_mpi_debug -3.791001520298101e+01 -1.016076112136943e-12 -5.347769011247070e-03 PASS
eb_fosscuda-2022a -3.791001520298107e+01 -1.072919530997751e-12 -5.646944899988165e-03 PASS