Input 14-absorption-spinors.01-gs.inp

Commits > Commit 68887e7ef149674fa38f143e8d88a44249e6d867 > Run cuda-serial: [foss2022a-cuda-mpi]

Matches

Name Value Reference Precision Difference Status
SCF convergence 1.000000000000000e+00 1.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Initial energy -6.136214870000000e+00 -6.136214930000000e+00 3.070000000000000e-07 6.000000052353016e-08 PASS
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