Match comparison for Kinetic energy (match type 26861)

Commits > Commit c9606f298ccf4e57d14167459d26815f7508aa3e > Input 10-vdw_d3_dna.02-gs_d3.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
1.740758280600000e+02 2.570000000000000e-06 1.740758262900000e+02 7.681753287582504e-07 1.740758280500000e+02 2.350000002593333e-06 PASS

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Detailed information

Reference: 174.07582806, precision: 0.00000257
Run Value Difference Relative difference Status
foss_cmake: [foss2022a-serial, foss-min] 1.740758261600000e+02 -1.900000000887303e-06 -7.392996112401957e-01 PASS
foss_min_autotools: [foss2023a-serial] 1.740758261600000e+02 -1.900000000887303e-06 -7.392996112401957e-01 PASS
foss_min_autotools: [foss2022a-serial] 1.740758261600000e+02 -1.900000000887303e-06 -7.392996112401957e-01 PASS
intel_autotools: [intel2023a-serial] 1.740758304000000e+02 2.340000008871357e-06 9.105058400277654e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] 1.740758261600000e+02 -1.900000000887303e-06 -7.392996112401957e-01 PASS
foss_min_autotools: [foss2023b-serial] 1.740758261600000e+02 -1.900000000887303e-06 -7.392996112401957e-01 PASS
foss_autotools: [foss2023a-serial] 1.740758261600000e+02 -1.900000000887303e-06 -7.392996112401957e-01 PASS
foss_opt_autotools: [foss2023a-serial] 1.740758261600000e+02 -1.900000000887303e-06 -7.392996112401957e-01 PASS
foss_autotools: [foss2023b-serial] 1.740758261600000e+02 -1.900000000887303e-06 -7.392996112401957e-01 PASS
foss_autotools: [foss2022a-serial] 1.740758261600000e+02 -1.900000000887303e-06 -7.392996112401957e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] 1.740758261600000e+02 -1.900000000887303e-06 -7.392996112401957e-01 PASS
foss_mpi_min_autotools: [foss2023a-mpi] 1.740758261600000e+02 -1.900000000887303e-06 -7.392996112401957e-01 PASS
foss_mpi_min_autotools: [foss2022a-mpi] 1.740758261600000e+02 -1.900000000887303e-06 -7.392996112401957e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] 1.740758261600000e+02 -1.900000000887303e-06 -7.392996112401957e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] 1.740758261600000e+02 -1.900000000887303e-06 -7.392996112401957e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] 1.740758261600000e+02 -1.900000000887303e-06 -7.392996112401957e-01 PASS
foss_debug_autotools: [foss2023a-serial] 1.740758261600000e+02 -1.900000000887303e-06 -7.392996112401957e-01 PASS
foss_omp_autotools: [foss2023a-serial] 1.740758261600000e+02 -1.900000000887303e-06 -7.392996112401957e-01 PASS
intel_omp_autotools: [intel2022a-serial] 1.740758261600000e+02 -1.900000000887303e-06 -7.392996112401957e-01 PASS
foss_mpi_autotools: [foss2023a-mpi] 1.740758261600000e+02 -1.900000000887303e-06 -7.392996112401957e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] 1.740758261600000e+02 -1.900000000887303e-06 -7.392996112401957e-01 PASS
intel_omp_autotools: [intel2023a-serial] 1.740758261600000e+02 -1.900000000887303e-06 -7.392996112401957e-01 PASS
foss_ppc_autotools: [foss2022a-serial] 1.740758263000000e+02 -1.760000003514506e-06 -6.848249040912474e-01 PASS
foss_mpi_autotools: [foss2022a-mpi] 1.740758261600000e+02 -1.900000000887303e-06 -7.392996112401957e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] 1.740758261600000e+02 -1.900000000887303e-06 -7.392996112401957e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] 1.740758261600000e+02 -1.900000000887303e-06 -7.392996112401957e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] 1.740758257000000e+02 -2.359999996315310e-06 -9.182879363094589e-01 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] 1.740758261700000e+02 -1.889999992954472e-06 -7.354085575698335e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] 1.740758261300000e+02 -1.929999996264087e-06 -7.509727611922516e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] 1.740758261600000e+02 -1.900000000887303e-06 -7.392996112401957e-01 PASS