Match XCrySDen geometry
Commits >
Commit d3675615d01b7319f97a471d787a8168906684ed >
Run intel-2022a_impi >
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)