Package org.jmol.symmetry
Class SpaceGroupFinder
java.lang.Object
org.jmol.symmetry.SpaceGroupFinder
A relatively simple space group finder given a unit cell. The unit cell is
used to reduce the options involving hexagonal, tetragonal, and cubic groups.
See https://stokes.byu.edu/iso/findsymform.php for finding the space group
given no unit cell information.
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Constructor Summary
Constructors -
Method Summary
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Constructor Details
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SpaceGroupFinder
public SpaceGroupFinder()
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Method Details
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checkSupercell
Look for a supercell and adjust lattice down if necessary.- Parameters:
vwr
-uc
-bsPoints
-abc
- 1==a, 2==b, 3==cscaling
- set to [na, nb, nc]- Returns:
- revised unit cell
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main
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