Match XSF natoms
Commits >
Commit 45adf9b0e5ec0c590d65885bc40efffc0d377767 >
Run foss-serial-full: [foss2023a-serial] >
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)