def test_isotopes_are_parsed_correctly(self):
"""
Test that isotopes in the file in the format `element:P` are valid
"""
wks_grp = SimulatedDensityOfStates(PHONONFile=self._isotope_phonon,
SpectrumType='DOS',
Ions='H:P,C:P,O')
self.assertEqual(3, wks_grp.size())
self.assertTrue(_is_name_material_in_group(wks_group = wks_grp, \
name_to_find = 'wks_grp_C(13)', material_to_find = '(C13)'))
def test_isotopes_are_parsed_correctly(self):
"""
Test that isotopes in the file in the format `element:P` are valid
"""
wks_grp = SimulatedDensityOfStates(PHONONFile=self._isotope_phonon,
SpectrumType='DOS',
Ions='H:P,C:P,O')
self.assertEqual(3, wks_grp.size())
self.assertEqual('wks_grp_C(13)', wks_grp.getItem(0).getName())
self.assertEqual('(C13)', wks_grp.getItem(0).sample().getMaterial().name())
def test_isotopes_are_parsed_correctly(self):
"""
Test that isotopes in the file in the format `element:P` are valid
"""
wks_grp = SimulatedDensityOfStates(PHONONFile=self._isotope_phonon,
SpectrumType='DOS',
Ions='H:P,C:P,O')
self.assertEqual(3, wks_grp.size())
self.assertTrue(_is_name_material_in_group(wks_group = wks_grp, \
name_to_find = 'wks_grp_C(13)', material_to_find = '(C13)'))
