def setUp(self): with open(os.path.join(test_dir, "NaCl_ph_dos.json"), "r") as f: self.dos = PhononDos.from_dict(json.load(f)) with open(os.path.join(test_dir, "NaCl_complete_ph_dos.json"), "r") as f: self.structure = CompletePhononDos.from_dict( json.load(f)).structure
def setUp(self): with open( os.path.join(PymatgenTest.TEST_FILES_DIR, "NaCl_complete_ph_dos.json")) as f: self.dos = CompletePhononDos.from_dict(json.load(f)) self.plotter = PhononDosPlotter(sigma=0.2, stack=True) self.plotter_nostack = PhononDosPlotter(sigma=0.2, stack=False)
def setUp(self): with open(os.path.join(PymatgenTest.TEST_FILES_DIR, "NaCl_ph_dos.json")) as f: self.dos = PhononDos.from_dict(json.load(f)) with open( os.path.join(PymatgenTest.TEST_FILES_DIR, "NaCl_complete_ph_dos.json")) as f: self.structure = CompletePhononDos.from_dict( json.load(f)).structure
def setUp(self): with open(os.path.join(test_dir, "NaCl_complete_ph_dos.json"), "r") as f: self.dos = CompletePhononDos.from_dict(json.load(f)) self.plotter = ThermoPlotter(self.dos, self.dos.structure)
def setUp(self): with open(os.path.join(test_dir, "NaCl_complete_ph_dos.json"), "r") as f: self.dos = CompletePhononDos.from_dict(json.load(f)) self.plotter = PhononDosPlotter(sigma=0.2, stack=True)
def setUp(self): with open(os.path.join(test_dir, "NaCl_complete_ph_dos.json"), "r") as f: self.cdos = CompletePhononDos.from_dict(json.load(f))
def setUp(self): with open(os.path.join(test_dir, "NaCl_complete_ph_dos.json"), "r") as f: self.dos = CompletePhononDos.from_dict(json.load(f)) self.plotter = PhononDosPlotter(sigma=0.2, stack=True) self.plotter_nostack = PhononDosPlotter(sigma=0.2, stack=False)
def setUp(self): with open( os.path.join(PymatgenTest.TEST_FILES_DIR, "NaCl_complete_ph_dos.json")) as f: self.dos = CompletePhononDos.from_dict(json.load(f)) self.plotter = ThermoPlotter(self.dos, self.dos.structure)