Match Energy [step 0]
Commits >
Commit f4bc596bdcf3afff33b833944576bfd5457df1bc >
Run foss-mpi-debug: [foss2023a-mpi] >
Input 23-td_qedft_breit_pxlda_adiabatic.02-td.inp
Value | Reference | Precision | Status |
-1.351259613523187e+01 | -1.351259613523188e+01 | 2.520000000000000e-13 | PASS |
Command: LINEFIELD(td.general/energy, -53, 3)