Match Total energy
Commits >
Commit ea6affb390844fd1d159151b43e705a091215c1a >
Run spack_foss-2022a_cuda_serial >
Input 31-acetylene_b3lyp.01-gs.inp
| Value | Reference | Precision | Status |
| -1.333939689000000e+01 | -1.333939704000000e+01 | 1.600000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)