Input 03-td_self_consistent.01-gs.inp

Commits > Commit adc9f2ea8065b70b337db7e35c2a67771b9e5a60 > Run foss-mpi-debug: [foss2023a-mpi]

Matches

Name Value Reference Precision Difference Status
SCF convergence 1.000000000000000e+00 1.000000000000000e+00 1.000000000000000e-06 0.000000000000000e+00 PASS
Initial energy -1.060686610000000e+01 -1.060686610000000e+01 5.300000000000000e-07 0.000000000000000e+00 PASS
Compare to other inputs