k-vector todos #15
Labels
enhancement
New feature or request
In progress
this is being addressed but is not complete
ORNL
Bug or need identified/requested by ORNL user/staff
(bug) NiO with space group R-3m and k=(0,0,3/2) with respect to the conventional cell (hexagonal axes). This one doesn't seem to work correctly: when searching high symmetry points, (0,0,3/2) doesn't appear in the list of potential solutions, which suggests there's a bug in either the conventional/primitive cell conversion or the d-spacing calculation.
The "HighSymPts & HighSymPaths" option actually searches only HighSymPaths. So we should change the label.
replacing the tolerance box with a "List top N results" box, that defaults to show the top 10 results (if there are more than 10, and all results otherwise).
isodistort
implementationList Avg. \delta(d) and Max. \delta(d) in the table, as well as Avg. \delta(d)/d.
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