Match comparison for Exchange energy (match type 30883)

Commits > Commit c9606f298ccf4e57d14167459d26815f7508aa3e > Input 01-nio.01-U5-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.092040214000000e+01 4.670000000000000e-07 -3.092040191866666e+01 1.268787700853510e-07 -3.092040191500000e+01 2.250000008530151e-07 PASS

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Detailed information

Reference: -30.920402139999997, precision: 0.000000467
Run Value Difference Relative difference Status
intel_autotools: [intel2023a-serial] -3.092040214000000e+01 -3.552713678800501e-15 -7.607523937474306e-09 PASS
foss_cmake: [foss2022a-serial, foss-min] -3.092040194000000e+01 1.999999952317921e-07 4.282655144149725e-01 PASS
foss_min_autotools: [foss2023a-serial] -3.092040183000000e+01 3.099999972278056e-07 6.638115572329885e-01 PASS
foss_min_autotools: [foss2022a-serial] -3.092040194000000e+01 1.999999952317921e-07 4.282655144149725e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -3.092040194000000e+01 1.999999952317921e-07 4.282655144149725e-01 PASS
foss_min_autotools: [foss2023b-serial] -3.092040183000000e+01 3.099999972278056e-07 6.638115572329885e-01 PASS
foss_autotools: [foss2023a-serial] -3.092040183000000e+01 3.099999972278056e-07 6.638115572329885e-01 PASS
foss_opt_autotools: [foss2023a-serial] -3.092040183000000e+01 3.099999972278056e-07 6.638115572329885e-01 PASS
foss_autotools: [foss2023b-serial] -3.092040183000000e+01 3.099999972278056e-07 6.638115572329885e-01 PASS
foss_autotools: [foss2022a-serial] -3.092040194000000e+01 1.999999952317921e-07 4.282655144149725e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -3.092040214000000e+01 -3.552713678800501e-15 -7.607523937474306e-09 PASS
foss_mpi_min_autotools: [foss2023a-mpi] -3.092040188000000e+01 2.599999966435007e-07 5.567451748254834e-01 PASS
foss_mpi_min_autotools: [foss2022a-mpi] -3.092040214000000e+01 -3.552713678800501e-15 -7.607523937474306e-09 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -3.092040214000000e+01 -3.552713678800501e-15 -7.607523937474306e-09 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -3.092040188000000e+01 2.599999966435007e-07 5.567451748254834e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -3.092040188000000e+01 2.599999966435007e-07 5.567451748254834e-01 PASS
foss_debug_autotools: [foss2023a-serial] -3.092040183000000e+01 3.099999972278056e-07 6.638115572329885e-01 PASS
foss_omp_autotools: [foss2023a-serial] -3.092040194000000e+01 1.999999952317921e-07 4.282655144149725e-01 PASS
intel_omp_autotools: [intel2022a-serial] -3.092040170000000e+01 4.399999973259128e-07 9.421841484494921e-01 PASS
foss_mpi_autotools: [foss2023a-mpi] -3.092040188000000e+01 2.599999966435007e-07 5.567451748254834e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -3.092040188000000e+01 2.599999966435007e-07 5.567451748254834e-01 PASS
intel_omp_autotools: [intel2023a-serial] -3.092040196000000e+01 1.799999971296984e-07 3.854389660164848e-01 PASS
foss_ppc_autotools: [foss2022a-serial] -3.092040209000000e+01 4.999999703159119e-08 1.070663747999811e-01 PASS
foss_mpi_autotools: [foss2022a-mpi] -3.092040214000000e+01 -3.552713678800501e-15 -7.607523937474306e-09 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -3.092040188000000e+01 2.599999966435007e-07 5.567451748254834e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -3.092040169000000e+01 4.499999981533165e-07 9.635974264524978e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -3.092040195000000e+01 1.899999979571021e-07 4.068522440194906e-01 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -3.092040186000000e+01 2.799999982983081e-07 5.995717308314950e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -3.092040194000000e+01 1.999999952317921e-07 4.282655144149725e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -3.092040171000000e+01 4.299999964985091e-07 9.207708704464862e-01 PASS