If you were lazy you'd just run phaser ;-)

--
Tim Gruene
Institut fuer anorganische Chemie
Tammannstr. 4
D-37077 Goettingen

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On Fri, 17 Apr 2009, James Stroud wrote:

Update:

The pounding I am beginning to feel in my head is reminiscent of a pounding I felt while working in p43212 a while ago. I think this is an alternate origin issue. Now I just need to figure out how to redefine the origin.

James


On Apr 16, 2009, at 9:38 PM, James Stroud wrote:

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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