Match XSF natoms
Commits >
Commit c1843387c3c25bf42356cee40f04165a0aff5f6f >
Run foss-mpi-debug: [foss2023a-mpi] >
Input 05-lithium.01-gs.inp
| Value | Reference | Precision | Status |
| 2.000000000000000e+00 | 2.000000000000000e+00 | 1.000000000000000e-01 | PASS |
Command: GREPFIELD(static/density.xsf, 'PRIMCOORD', 1, 1)