Match eigenvalue [3]
Commits >
Commit adb0a770f40b5954f8a07de2fe2e63c9718fe526 >
Run eb_foss-2022a_mpi >
Input 32-tdpcm_methane.01-ground_state.inp
Value | Reference | Precision | Status |
-9.387470000000000e+00 | -9.387470000000000e+00 | 4.690000000000000e-04 | PASS |
Command: GREPFIELD(static/info, '3 --', 3)