Quick Build function
qzhu2017 opened this issue · comments
Qiang Zhu commented
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'
Qiang Zhu commented
as well as topology strings
Qiang Zhu commented
Major Feature enhancement for v0.6.0