Match XSF natoms
Commits >
Commit 917d830e9234ff154f8a96d6b6c157a89a03a450 >
Run foss_mpi_opt_autotools: [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)