Match Eigenvalues sum
Commits >
Commit f4bc596bdcf3afff33b833944576bfd5457df1bc >
Run foss-mpi-min: [foss2023a-mpi] >
Input 14-fullerene_unpacked.01-gs.inp
Value | Reference | Precision | Status |
-6.846075073999999e+01 | -6.846081588499999e+01 | 7.169999999999999e-05 | PASS |
Command: GREPFIELD(static/info, 'Eigenvalues =', 3)