Match Initial energy
Commits >
Commit 16cdfcecc1be9b3eac0dbe4ff8b1dc79e6b9a001 >
Run foss_autotools: [foss2023a-serial] >
Input 12-absorption.01-gs.inp
Value | Reference | Precision | Status |
-5.816213230000000e+00 | -5.816213230000001e+00 | 2.910000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)