Input 15-electronic_system_restart.04-td_restart_part2.inp

Commits > Commit 3d047708c1ab8d71894fb240c9b3cff2ecebd198 > Run foss-mpi-omp-full: [foss2023a-mpi]

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060686608766763e+01 -1.060686608766760e+01 1.060000000000000e-13 -2.486899575160351e-14 PASS
Energy [step 20] -1.060637353666430e+01 -1.060637353666430e+01 1.060000000000000e-13 -3.552713678800501e-15 PASS
Multipoles [step 0] 6.042978617504246e-16 -8.908015926463452e-16 4.090000000000000e-15 1.495099454396770e-15 PASS
Multipoles [step 20] -1.265509664058058e-01 -1.265509664057956e-01 1.310000000000000e-14 -1.015854067532018e-14 PASS
Compare to other inputs