Match Energy [step 0]
Commits >
Commit 701869cc1eb5c6c77a64efba9e1ed1058e4204f9 >
Run intel-parallel-debug: [intel2023a-mpi] >
Input 23-td_qedft_breit_pxlda_adiabatic.02-td.inp
Value | Reference | Precision | Status |
-1.351259613523192e+01 | -1.351259613523188e+01 | 2.520000000000000e-13 | PASS |
Command: LINEFIELD(td.general/energy, -53, 3)