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Quick Build function #221
Labels
enhancement
New feature or request
Comments
as well as topology strings |
Major Feature enhancement for v0.6.0 |
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A list of prototypes for quick build
Name: 'diamond'
Spg: 227,
Element: ['C']
wp: [['8a']]
l: 3.56
Name: 'zincblende'
Spg: 216,
Element: ['Zn', 'S']
wp: [[], []]
l: 5.41
Name: 'rocksalt'
Spg:
Element: ['Zn', 'S']
wp:
l:
Name: 'wurzite'
Name: 'graphite'
Name: 'alpha quartz'
Name: 'beta quartz'
Name: 'alpha cristobalite'
Name: 'beta cristobalite'
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