Input 04-lithium.02-absorbing_boundaries.inp

Commits > Commit 4b6d45842a438d46c51308ffa6e74b875e60d9e9 > Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi]

Matches

Name Value Reference Precision Difference Status
N_electrons [step 0] 3.000000000000001e+00 3.000000000000000e+00 2.000000000000000e-07 8.881784197001252e-16 PASS
N_electrons [step 500] 2.319032352799076e+00 2.319032630881478e+00 3.060000000000000e-07 -2.780824019943395e-07 PASS
norm11 [step 0] 9.999999999999999e-01 1.000000000000000e+00 1.300000000000000e-07 -1.110223024625157e-16 PASS
norm11 [step 500] 8.562171986985783e-01 8.562172473301963e-01 7.470000000000000e-08 -4.863161806589744e-08 PASS
norm21 [step 0] 1.000000000000000e+00 1.000000000000000e+00 1.300000000000000e-07 2.220446049250313e-16 PASS
norm21 [step 500] 9.153054500649183e-01 9.153054729587488e-01 2.520000000000000e-08 -2.289383049802751e-08 PASS
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