Match Energy [step 52]
Commits >
Commit b6caf805fea115365f1246dd8a44b3bc3b7dd03a >
Run spack_foss-2022a_mpi_debug >
Input 23-td_qedft_breit_pxlda_adiabatic.02-td.inp
Value | Reference | Precision | Status |
-1.351350086579631e+01 | -1.351350086579652e+01 | 5.000000000000000e-13 | PASS |
Command: LINEFIELD(td.general/energy, -1, 3)