Ques. on high symm points of a crystal

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The discussion centers on the existence of a high symmetry point in crystals around which all point operations can be re-centered. It is established that for complex crystals, such as the diamond structure, the center of symmetry is located at coordinates 1/8, 1/8, 1/8. However, due to the presence of a diad perpendicular to each cube face, this point cannot accommodate all operations. The user seeks to develop a program to test all 48 possible operations around such symmetry points.

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sam_bell
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Hi! I'm new to these forums.

To get right to it, My head'z been spinning wondering ..

Is there a high symmetry point in a crystal about which *all* point operations can be re-centered? I can show this for a simple lattice.

Does anyone know if this is true for any complex crystal as well? And maybe how to show it? I'm asking because I want to write a program that sets the origin of coordinates at such a point and then tests all 48 possible operations about it. I know some good candidates would be at the atom centers and the midpoint between atoms.

Any knowledge/suggestions is appreciated. Thanks.
 
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No, that's not possible. Think about the diamond structure for example. The center of symmetry is at 1/8 1/8 1/8, so this would be your only option for such a point. But the crystal has a diad perpendicular to each cube face, which cannot be placed so that it runs through the center of symmetry.

I can't give a more general answer unfortunately.
 

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