Match External energy
Commits >
Commit 61d12a07bb2f18211cbe349e5d87c7e10e0bf297 >
Run intel_omp_autotools: [intel2022a-serial] >
Input 31-acetylene_b3lyp.01-gs.inp
Value | Reference | Precision | Status |
-5.378298528000000e+01 | -5.378298553000000e+01 | 6.930000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'External =', 3)