Help With Gamma Alumina Structure.

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Prabhsimran Singh

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Oct 16, 2024, 11:10:18 PM10/16/24
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Hello,

I am trying to make gamma alumina using the data given in the table 1 here. After putting in lattice parameter and x y z value I am getting crystal structure but the oct and get wyckoff notation is interchanged..

can someone guide me on this also where to put basis vector and how to change origin to -3m.
Screenshot 2024-10-16 at 10.51.33 PM.png


Screenshot 2024-10-16 at 10.54.39 PM.png

Keshav Kumar

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Oct 18, 2024, 12:31:34 AM10/18/24
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Hi Singh.
Fill in the details you have taken from literature and choose origin 2 as shown in the attached pick. Maybe this will help you.



With regards
Keshav

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------------------------------------------------
Dr. Keshav Kumar
Research Associate, JNCASR,
Jakkur, Bangalore- 560064, India
M.No. +919532524401       
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Prabhsimran Singh

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Oct 18, 2024, 12:32:39 AM10/18/24
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Update My tetrahedral and Octahedral are at right Wyckoff positions its just xyzzy coordinated and Wyckoff positions are interchanged. Can I fix that
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