Match Total energy
Commits >
Commit 7368b0b20aad13e0ecfc3e36ba5b1a9f5c3d54b1 >
Run spack_foss-2023a_serial_min >
Input 31-acetylene_b3lyp.01-gs.inp
| Value | Reference | Precision | Status |
| -1.333925457000000e+01 | -1.333925462000000e+01 | 6.670000000000000e-08 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)