Closed rowlesmr closed 1 year ago
I don't think the move between categories of itself changes the _type.source
, rather it is whether or not the values can be derived from other quantities that have data names defined. I suspect the original classification of Recorded
might have been a leftover from the days when reflections were measured separately on a point detector, from which cell parameters where calculated and then used to position the gonio for each hkl. The items going into that cell parameter calculation were not necessarily captured by CIF. Anyway, happy for these to be derived, as you could argue that the contributing reflections are listed in DIFFRN_ORIENT_REFLN
.
will close #439
With moving
CELL
fromEXPTL
toDIFFRN
, the related parameters should no longer beRecorded
.