Match comparison for Hartree energy (match type 26857)

Commits > Commit 9a893b9dbe73f1d3f49cd24e2707361da541a5ca > Input 10-vdw_d3_dna.02-gs_d3.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
3.356149938300000e+02 8.410000000000001e-06 3.356149998436842e+02 4.247886422745622e-06 3.356149945100000e+02 7.000000010748408e-06 PASS

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Detailed information

Reference: 335.61499383, precision: 0.00000841
Run Value Difference Relative difference Status
foss-serial-zen4: [foss2023a-serial] 3.356150014700000e+02 7.639999978437118e-06 9.084423279949009e-01 PASS
intel-serial: [intel2023a-serial] 3.356150012900000e+02 7.460000006176415e-06 8.870392397356022e-01 PASS
foss-serial-debug: [foss2023a-serial] 3.356149875100000e+02 -6.320000011328375e-06 -7.514863271496284e-01 PASS
intel-min-parallel: [intel2022a-mpi] 3.356150015100000e+02 7.680000010168442e-06 9.131985743363188e-01 PASS
intel-parallel: [intel2023a-mpi] 3.356150014000000e+02 7.569999979750719e-06 9.001189036564469e-01 PASS
foss-parallel-zen4: [foss2023a-mpi] 3.356150014800000e+02 7.649999986369949e-06 9.096313895802554e-01 PASS
foss-min-parallel-zen4: [foss2023a-mpi] 3.356150014800000e+02 7.649999986369949e-06 9.096313895802554e-01 PASS
autotools_foss_mpi_omp: [foss2023a-mpi] 3.356150014800000e+02 7.649999986369949e-06 9.096313895802554e-01 PASS
foss-serial: [foss2023a-serial] 3.356149875100000e+02 -6.320000011328375e-06 -7.514863271496284e-01 PASS
foss-parallel-debug: [foss2023a-mpi] 3.356150014800000e+02 7.649999986369949e-06 9.096313895802554e-01 PASS
ppc: [foss2023a-serial] 3.356150014100000e+02 7.579999987683550e-06 9.013079652418013e-01 PASS
cuda: [foss2022a-cuda-mpi, ci-foss-full-cuda] 3.356150002400000e+02 6.409999969037017e-06 7.621878678997641e-01 PASS
autotools_intel_mpi_omp: [intel2023a-mpi] 3.356150014800000e+02 7.649999986369949e-06 9.096313895802554e-01 PASS
intel-serial-debug: [intel2023a-serial] 3.356150012900000e+02 7.460000006176415e-06 8.870392397356022e-01 PASS
foss-parallel: [foss2023a-mpi] 3.356150014800000e+02 7.649999986369949e-06 9.096313895802554e-01 PASS
foss-min-parallel: [foss2023b-mpi] 3.356150014800000e+02 7.649999986369949e-06 9.096313895802554e-01 PASS
intel-parallel-debug: [intel2023a-mpi] 3.356150014000000e+02 7.569999979750719e-06 9.001189036564469e-01 PASS
cuda: [foss2022a-cuda-mpi, ci-foss-full-mpi-omp-cuda] 3.356150001500000e+02 6.320000011328375e-06 7.514863271496284e-01 PASS
foss-min-parallel: [foss2022a-mpi] 3.356150014900000e+02 7.659999994302780e-06 9.108204511656098e-01 PASS