Match XCrySDen geometry
Commits >
Commit b15abc005d0b5301cd748c91bbd98ee634ebaa25 >
Run spack_foss-2023a_mpi >
Input 05-output.02-gs.inp
| Value | Reference | Precision | Status |
| 2.645886000000000e+00 | 2.645886000000000e+00 | 7.130000000000000e-13 | PASS |
Command: LINEFIELD(static/geometry.xsf, 2, 3)