Python AlphaQuartzGenerator Exemples

Exemple #1

Fichier : test_bulk_structure_generator.py Projet : chr7stos/scikit-nano

 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)

Exemple #2

Fichier : test_bulk_structure_generator.py Projet : haidi-ustc/scikit-nano

 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)

Exemple #3

Fichier : test_bulk_structure_generator.py Projet : chr7stos/scikit-nano

 def test1(self):
     quartz = AlphaQuartzGenerator()
     quartz.save()
     self.tmpdata.append(quartz.fname)
     assert_equal(quartz.atoms.Natoms, AlphaQuartz().basis.Natoms)

Exemple #4

Fichier : test_bulk_structure_generator.py Projet : haidi-ustc/scikit-nano

 def test1(self):
     quartz = AlphaQuartzGenerator()
     quartz.save()
     self.tmpdata.append(quartz.fname)
     assert_equal(quartz.atoms.Natoms, AlphaQuartz().basis.Natoms)