from abp import GraphState, VizClient from abp.util import xyz import numpy as np import time import itertools import networkx as nx threedee_unit_cell = ( (( 0, 0, 0), (0, 1, 0)), (( 0, 0, 0), (1, 0, 0)), (( 1, 0, 0), (1, 1, 0)), (( 0, 1, 0), (1, 1, 0)), (( 0, 0, 1), (0, 1, 1)), (( 0, 0, 1), (1, 0, 1)), (( 1, 0, 1), (1, 1, 1)), (( 0, 1, 1), (1, 1, 1)), (( 0, 0, 0), (0, 0, 1)), (( 0, 1, 0), (0, 1, 1)), (( 1, 0, 0), (1, 0, 1)), (( 1, 1, 0), (1, 1, 1)) ) def add_offset(vector, offset): """ Offset a vector in n-dimensional space """ return tuple(v + o for v, o in zip(vector, offset)) def offset_unit_cell(unit_cell, offset): """ Offset a unit cell """ return {(add_offset(a, offset), add_offset(b, offset)) for a, b in unit_cell} def lattice(unit_cell, size): """ Generate a lattice from a unit cell """ edges = set() for offset in itertools.product(*list(map(range, size))): edges |= offset_unit_cell(unit_cell, offset) nodes = set(itertools.chain(*edges)) return nodes, edges nodes, edges = lattice(threedee_unit_cell, (3, 3, 3)) psi = GraphState(nodes) for a, b in edges: psi.act_cz(a, b) v = VizClient() v.update(psi)