Match XSF natoms
Commits >
Commit 6873b983d1904fe0612bd483f61737dd2d8ed971 >
Run foss-mpi-omp-full: [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)