Input 22-multitrajectory.01-gs.inp

Commits > Commit 57f8ca8d342504024fed98c8f4356f69f5870627 > Run cuda-mpi-omp: [foss2022a-cuda-mpi]

Matches

Name Value Reference Precision Difference Status
Replica 1 converged 1.000000000000000e+00 1.000000000000000e+00 1.000000000000000e-01 0.000000000000000e+00 PASS
Replica 2 converged 1.000000000000000e+00 1.000000000000000e+00 1.000000000000000e-01 0.000000000000000e+00 PASS
Replica 3 converged 1.000000000000000e+00 1.000000000000000e+00 1.000000000000000e-01 0.000000000000000e+00 PASS
Replica 1 C x-pos -7.639980000000000e-01 -7.639980000000000e-01 1.000000000000000e-05 0.000000000000000e+00 PASS
Replica 2 C x-pos -7.511570000000000e-01 -7.511570000000000e-01 1.000000000000000e-05 0.000000000000000e+00 PASS
Replica 3 C x-pos -7.269540000000000e-01 -7.269540000000000e-01 1.000000000000000e-05 0.000000000000000e+00 PASS
Replica 1 dipole -2.122210000000000e-15 0.000000000000000e+00 3.000000000000000e-06 -2.122210000000000e-15 PASS
Replica 2 dipole -2.253350000000000e-16 0.000000000000000e+00 3.000000000000000e-06 -2.253350000000000e-16 PASS
Replica 3 dipole -9.204510000000000e-15 0.000000000000000e+00 3.000000000000000e-06 -9.204510000000000e-15 PASS
Compare to other inputs