def test1(self):
mwnt = MWNTGenerator(max_walls=3, Lz=1.0)
print(mwnt)
print(mwnt.todict())
mwnt.save()
self.tmpdata.append(mwnt.fname)
mwnt.save(structure_format='data')
self.tmpdata.append(mwnt.fname)
def test3(self):
mwnt = MWNTGenerator(Ch=[(5, 5), (10, 10), (20, 20)], Lz=1.0)
print(mwnt)
print(mwnt.todict())
assert_equal(mwnt.Nwalls, 3)
assert_equal(mwnt.chiral_set, set(['armchair']))
mwnt.save()
self.tmpdata.append(mwnt.fname)
mwnt.save(structure_format='data')
self.tmpdata.append(mwnt.fname)
def test1(self):
mwnt = MWNTGenerator(max_walls=3, Lz=1.0)
print(mwnt)
print(mwnt.todict())
mwnt.save()
self.tmpdata.append(mwnt.fname)
mwnt.save(structure_format='data')
self.tmpdata.append(mwnt.fname)
def test3(self):
mwnt = MWNTGenerator(Ch=[(5, 5), (10, 10), (20, 20)], Lz=1.0)
print(mwnt)
print(mwnt.todict())
assert_equal(mwnt.Nwalls, 3)
assert_equal(mwnt.chiral_set, set(['armchair']))
mwnt.save()
self.tmpdata.append(mwnt.fname)
mwnt.save(structure_format='data')
self.tmpdata.append(mwnt.fname)
def test4(self):
Ch_list = [(3, 3), (4, 4), (5, 5)]
mwnt = MWNTGenerator(Ch_list=Ch_list, Lz=1.0)
bundle = MWNTBundleGenerator(Ch_list=Ch_list, nx=3, ny=2, Lz=1.0)
assert_true(bundle.Natoms, bundle.Ntubes * mwnt.Natoms)
