Match External energy
Commits >
Commit 15b914f6cf8a906b04634cf1151edac44a3f54fa >
Run spack_foss-2022a_ppc >
Input 31-acetylene_b3lyp.01-gs.inp
Value | Reference | Precision | Status |
-5.378242050000000e+01 | -5.378242078000000e+01 | 3.030000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'External =', 3)