Match Initial energy
Commits >
Commit 8f70c6ee77762d8b3d61df63beb761c1a94f9b18 >
Run foss_mpi_debug_autotools: [foss2023a-mpi] >
Input 12-tddft-currents-to-maxwell.01-benzene-gs.inp
Value | Reference | Precision | Status |
-3.744576714000000e+01 | -3.744576068000000e+01 | 1.000000000000000e-04 | PASS |
Command: GREPFIELD(benzene/static/info, 'Total =', 3)