Hello All,
I have two crystals (that I'll call "data set 1" and "data set 2")
that seem to be isomorphic, but y and z are transposed between the two
data sets. Reindexing data set 2 with the operators
h => -h
k => l
l => k
makes the axes match data set 1, but running MR with the previous data
set 2 solution on the newly reindexed data set 2 yields a solution
rotated 180 about z with respect to the data set 1 solution. What is
the operation to reindex such that real space is rotated 180 about z?
These are in P212121.
James
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