Match Eigenvalues sum
Commits >
Commit 49118372ba86b967cc9f5fccbbf24835f53b10d7 >
Run cmake_foss_2022a_min_mpi >
Input 31-acetylene_b3lyp.01-gs.inp
Value | Reference | Precision | Status |
-4.815925580000000e+00 | -4.815925660000000e+00 | 2.410000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Eigenvalues =', 3)