Match eigenvalue [1]
Commits >
Commit 3c5618978387ff506850febf67c434621a2adfa2 >
Run foss-mpi-debug: [foss2023a-mpi] >
Input 32-tdpcm_methane.01-ground_state.inp
Value | Reference | Precision | Status |
-1.681004000000000e+01 | -1.681004000000000e+01 | 8.410000000000000e-05 | PASS |
Command: GREPFIELD(static/info, '1 --', 3)