def test_filter(self):
s = self.get_structure("Li10GeP2S12")
sf = SpecieProximityFilter({"Li": 1})
self.assertTrue(sf.test(s))
sf = SpecieProximityFilter({"Li": 2})
self.assertFalse(sf.test(s))
sf = SpecieProximityFilter({"P": 1})
self.assertTrue(sf.test(s))
sf = SpecieProximityFilter({"P": 5})
self.assertFalse(sf.test(s))
def test_filter(self):
filename = os.path.join(test_dir, "Li10GeP2S12.cif")
p = CifParser(filename)
s = p.get_structures()[0]
sf = SpecieProximityFilter({"Li": 1})
self.assertTrue(sf.test(s))
sf = SpecieProximityFilter({"Li": 2})
self.assertFalse(sf.test(s))
sf = SpecieProximityFilter({"P": 1})
self.assertTrue(sf.test(s))
sf = SpecieProximityFilter({"P": 5})
self.assertFalse(sf.test(s))
def test_filter(self):
s = self.get_structure("Li10GeP2S12")
sf = SpecieProximityFilter({"Li": 1})
self.assertTrue(sf.test(s))
sf = SpecieProximityFilter({"Li": 2})
self.assertFalse(sf.test(s))
sf = SpecieProximityFilter({"P": 1})
self.assertTrue(sf.test(s))
sf = SpecieProximityFilter({"P": 5})
self.assertFalse(sf.test(s))
def test_to_from_dict(self):
sf = SpecieProximityFilter({"Li": 1})
d = sf.as_dict()
self.assertIsInstance(SpecieProximityFilter.from_dict(d),
SpecieProximityFilter)
def test_to_from_dict(self):
sf = SpecieProximityFilter({"Li": 1})
d = sf.as_dict()
self.assertIsInstance(SpecieProximityFilter.from_dict(d),
SpecieProximityFilter)
def test_filter(self):
filename = os.path.join(test_dir, "Li10GeP2S12.cif")
p = CifParser(filename)
s = p.get_structures()[0]
sf = SpecieProximityFilter({"Li": 1})
self.assertTrue(sf.test(s))
sf = SpecieProximityFilter({"Li": 2})
self.assertFalse(sf.test(s))
sf = SpecieProximityFilter({"P": 1})
self.assertTrue(sf.test(s))
sf = SpecieProximityFilter({"P": 5})
self.assertFalse(sf.test(s))