Input 22-td_move_ions_periodic.01-gs.inp

Commits > Commit dbbd967b788cdda4a2df74a46ac2e5066a09d99b > Run intel-serial: [intel2023a-serial]

Matches

Name Value Reference Precision Difference Status
SCF convergence 1.000000000000000e+00 1.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Initial energy -2.965691066000000e+01 -2.965691066000000e+01 1.480000000000000e-07 0.000000000000000e+00 PASS
Compare to other inputs