def test2(self): quartz = AlphaQuartzGenerator(scaling_matrix=[2, 2, 2]) quartz.save() self.tmpdata.append(quartz.fname) assert_equal(quartz.atoms.Natoms, AlphaQuartz().basis.Natoms * 2 ** 3)
def test2(self): quartz = AlphaQuartzGenerator(scaling_matrix=[2, 2, 2]) quartz.save() self.tmpdata.append(quartz.fname) assert_equal(quartz.atoms.Natoms, AlphaQuartz().basis.Natoms * 2**3)
def test1(self): quartz = AlphaQuartzGenerator() quartz.save() self.tmpdata.append(quartz.fname) assert_equal(quartz.atoms.Natoms, AlphaQuartz().basis.Natoms)