Match comparison for Energy [step 2] (match type 23962)

Commits > Commit 42d5c2c12b8376ac01df1778205b77ce6ca96480 > Input 10-bomd.03-td_restart.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.058224116264840e+01 7.900000000000000e-09 -1.058224116310655e+01 6.999197426374688e-09 -1.058224116254388e+01 7.073527541479052e-09 PASS

Checks for this match

  • MPI builders have different values.
Loading plot...
Get updated match line Get updated match line with fixed reference

Detailed information

Reference: -10.5822411626484, precision: 0.0000000079
Run Value Difference Relative difference Status
cmake_foss_2022a_full_serial -1.058224116957157e+01 -6.923173145878536e-09 -8.763510311238654e-01 PASS
cmake_foss_2022a_full_mpi -1.058224115547339e+01 7.175007255000310e-09 9.082287664557355e-01 PASS
cmake_foss_2022a_min_serial -1.058224116957157e+01 -6.923173145878536e-09 -8.763510311238654e-01 PASS
cmake_foss_2022a_min_mpi -1.058224115547984e+01 7.168564408743805e-09 9.074132162966843e-01 PASS
spack_foss-2022a_cuda_mpi_omp -1.058224115547711e+01 7.171285787421766e-09 9.077576946103502e-01 PASS
spack_foss-2022a_mpi -1.058224115547673e+01 7.171665927785398e-09 9.078058136437213e-01 PASS
spack_foss-2022a_mpi_min -1.058224115557066e+01 7.077737507188431e-09 8.959161401504343e-01 PASS
spack_foss-2022a_serial -1.058224116952264e+01 -6.874245173094096e-09 -8.701576168473539e-01 PASS
spack_foss-2022a_serial_min -1.058224116952264e+01 -6.874245173094096e-09 -8.701576168473539e-01 PASS
spack_foss-2023a_mpi -1.058224115547673e+01 7.171665927785398e-09 9.078058136437213e-01 PASS
spack_foss-2023a_mpi_min -1.058224115557066e+01 7.077737507188431e-09 8.959161401504343e-01 PASS
spack_foss-2022a_cuda_serial -1.058224116952744e+01 -6.879039560203637e-09 -8.707645012915997e-01 PASS
spack_foss-2023a_serial -1.058224116952264e+01 -6.874245173094096e-09 -8.701576168473539e-01 PASS
spack_foss-2023a_mpi_opt -1.058224115547339e+01 7.175007255000310e-09 9.082287664557355e-01 PASS
spack_foss-2023a_serial_min -1.058224116952264e+01 -6.874245173094096e-09 -8.701576168473539e-01 PASS
spack_foss-2023a_mpi_omp -1.058224115547035e+01 7.178050154266202e-09 9.086139435780003e-01 PASS
spack_foss-2023a_serial_opt -1.058224116957157e+01 -6.923173145878536e-09 -8.763510311238654e-01 PASS
spack_foss-2023a_serial_omp -1.058224116961740e+01 -6.969004928691902e-09 -8.821525226192282e-01 PASS
spack_foss-2023b_serial -1.058224116952264e+01 -6.874245173094096e-09 -8.701576168473539e-01 PASS
spack_intel-2023a_serial -1.058224116952781e+01 -6.879407266069393e-09 -8.708110463378979e-01 PASS
spack_intel-2022a_serial_omp -1.058224116954098e+01 -6.892584281104064e-09 -8.724790229245651e-01 PASS
spack_intel-2023a_impi -1.058224115550385e+01 7.144548064275114e-09 9.043731726930524e-01 PASS
spack_intel-2023a_serial_omp -1.058224116954098e+01 -6.892584281104064e-09 -8.724790229245651e-01 PASS
spack_intel-2022a_impi_omp -1.058224115550203e+01 7.146368830035499e-09 9.046036493715822e-01 PASS