Match comparison for X Force Atom 1 [step 10] (match type 24691)

Commits > Commit 9bb80dbc43fc7b1ccbcadf899a686fb8cb0164a9 > Input 22-td_move_ions_periodic.02-td.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-5.427048672230912e+00 3.450000000000000e-10 -5.427048672544629e+00 1.142745906219420e-14 -5.427048672544629e+00 2.131628207280301e-14 PASS

Checks for this match

  • Mid point of values far away from reference. Recentering may be necessary.
Loading plot...
Get updated match line Get updated match line with fixed reference

Detailed information

Reference: -5.427048672230912, precision: 0.000000000345
Run Value Difference Relative difference Status
foss-2022a_ppc -5.427048672544608e+00 -3.136957360538872e-10 -9.092630030547456e-01 PASS
cmake_foss_2022a_full_serial -5.427048672544613e+00 -3.137010651244054e-10 -9.092784496359578e-01 PASS
cmake_foss_2022a_min_serial -5.427048672544613e+00 -3.137010651244054e-10 -9.092784496359578e-01 PASS
cmake_foss_2022a_min_mpi -5.427048672544622e+00 -3.137099469086024e-10 -9.093041939379781e-01 PASS
cmake_foss_2022a_full_mpi -5.427048672544639e+00 -3.137268222985767e-10 -9.093531081118166e-01 PASS
eb_foss-2022a -5.427048672544633e+00 -3.137214932280585e-10 -9.093376615306045e-01 PASS
eb_foss-2022a_debug -5.427048672544633e+00 -3.137214932280585e-10 -9.093376615306045e-01 PASS
eb_foss-2022a_mpi -5.427048672544628e+00 -3.137161641575403e-10 -9.093222149493922e-01 PASS
eb_foss-2022b_libxc6 -5.427048672544633e+00 -3.137214932280585e-10 -9.093376615306045e-01 PASS
foss-2022a_opt -5.427048672544633e+00 -3.137214932280585e-10 -9.093376615306045e-01 PASS
intel-2022a -5.427048672544650e+00 -3.137383686180328e-10 -9.093865757044430e-01 PASS
spack_foss-2022a_serial_omp -5.427048672544636e+00 -3.137241577633176e-10 -9.093453848212105e-01 PASS
eb_foss-2022b_libxc6_mpi -5.427048672544628e+00 -3.137161641575403e-10 -9.093222149493922e-01 PASS
foss-2022a_omp -5.427048672544636e+00 -3.137241577633176e-10 -9.093453848212105e-01 PASS
intel-2022b -5.427048672544650e+00 -3.137383686180328e-10 -9.093865757044430e-01 PASS
spack_foss-2022a_serial -5.427048672544613e+00 -3.137010651244054e-10 -9.092784496359578e-01 PASS
eb_foss-2022a_mpi_debug -5.427048672544628e+00 -3.137161641575403e-10 -9.093222149493922e-01 PASS
intel-2022a_omp -5.427048672544639e+00 -3.137268222985767e-10 -9.093531081118166e-01 PASS
intel-2022a_impi -5.427048672544628e+00 -3.137161641575403e-10 -9.093222149493922e-01 PASS
eb_fosscuda-2022a_mpi_omp -5.427048672544645e+00 -3.137330395475146e-10 -9.093711291232308e-01 PASS
intel-2022b_impi -5.427048672544628e+00 -3.137161641575403e-10 -9.093222149493922e-01 PASS
spack_foss-2022a_serial_debug -5.427048672544613e+00 -3.137010651244054e-10 -9.092784496359578e-01 PASS
foss-2022a_mpi_omp -5.427048672544622e+00 -3.137099469086024e-10 -9.093041939379781e-01 PASS
spack_foss-2022a_serial_min -5.427048672544613e+00 -3.137010651244054e-10 -9.092784496359578e-01 PASS
intel-2022a_omp_impi -5.427048672544633e+00 -3.137214932280585e-10 -9.093376615306045e-01 PASS
eb_fosscuda-2022a -5.427048672544631e+00 -3.137188286927994e-10 -9.093299382399984e-01 PASS