gyroid 0.1

A symmetry adapted basis function (SABF) generator.

gyroid is a python package that generates symmetry adapted basis functions based on the space group of a unit cell.

Quickstart

1. Install

$ easy_install gyroid

or

$ tar -xvf gyroid-xxx.tar.gz
$ cd gyroid-xxx
$ python setup.py install

2. Usage

>>>import gyroid as gy

>>>uc = gy.UnitCell(3)
>>>group = gy.Group(3,gy.BRAVAIS,uc.shape,"Ia-3d")
>>>grid = gy.Grid(np.array([4,4,4]),group)
>>>basis = gy.Basis(group,grid)

>>>render_structure_3d(basis,32,32,32,1.0)

Ask for Help

• You can directly contact me at [e-mail].

• You can join the mailinglist by sending an email to [e-mail] and replying to the confirmation mail. To unsubscribe, send a mail to [e-mail] and reply to the confirmation mail.

Links

• Website

• Development version