Material#

Crystal
Structure
Symmetry
Tables

The material module contains the functions for working with crystallographic and disordered structures.

import re

from disorder.material import tables

from disorder.graphical.canvas import Canvas
from disorder.graphical.plots import Scatter
from disorder.graphical import colors

Z = tables.Z
bc = tables.bc

no, sigma = [], []
for key in bc.keys():
    b, key = bc[key], re.sub(r'(^|\W)\d+', '', key)
    z = Z[key]
    sigma.append(4*np.pi*np.abs(b)**2)
    no.append(z)

canvas = Canvas()

scatter = Scatter(canvas)
scatter.plot_data(no, sigma, no)
scatter.set_labels(r'', r'$z$', r'$\sigma_c$')
scatter.set_axis_scales('linear', 'log')
scatter.sc.set_cmap(colors.elements)

canvas.close()