Input 19-td_move_ions.01-gs.inp

Commits > Commit 04b2a32c6063188a192f0d4e38b2e2adad504be9 > Run eb_fosscuda-2022a_mpi_omp

Matches

Name Value Reference Precision Difference Status
SCF convergence 1.000000000000000e+00 1.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Initial energy -2.964437839000000e+01 -2.964437839000000e+01 1.480000000000000e-09 -3.552713678800501e-15 PASS
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