def __init__(self, mainwindow, cell):
tk.Toplevel.__init__(self, mainwindow)
self.main_frame = tkinter.ttk.Frame(self)
self.main_frame.grid(sticky='nsew')
self.mainwindow = mainwindow
self.project = self.mainwindow.projects[self.mainwindow.currentprojectid]
self.bfpp = cell.bfpp
self.cell = cell
self.title(self.cell.treetitle + ' Band Fit Window')
# -------------------------------------------------- VARIABLES -------------------------------------------------
self.label1 = tk.Label(self.main_frame, text='Band fit parameters', font='-weight bold')
self.band_frame = tkinter.ttk.LabelFrame(self.main_frame, labelwidget=self.label1)
self.band_frame.grid(row=2, column=0, pady=3, sticky='nsew')
self.hs_kpoints_var = tk.StringVar(value=','.join(self.bfpp.hs_kpoints_names))
# High Symmetry K-points
hs_kpoints_frame = tkinter.ttk.Frame(self.band_frame)
hs_kpoints_frame.grid(pady=3, sticky='nsew')
tkinter.ttk.Label(hs_kpoints_frame, text='High symmetry K-points (comma-separated)').grid(sticky='nsew')
tkinter.ttk.Entry(hs_kpoints_frame, textvariable=self.hs_kpoints_var, width=20).grid(sticky='nsew')
# Energy range
self.vbm_range = tu.RangeFrame(self.band_frame, self.bfpp.bands_fit['VBM'].xfitmin, self.bfpp.bands_fit['VBM'].xfitmax, 'VBM fit range', '', width=6)
self.vbm_range.grid(sticky='nsew')
self.cbm_range = tu.RangeFrame(self.band_frame, self.bfpp.bands_fit['CBM'].xfitmin, self.bfpp.bands_fit['CBM'].xfitmax, 'CBM fit range', '', width=6)
self.cbm_range.grid(sticky='nsew')
# ---------------------------------------------- DISPLAY PARAMS ------------------------------------------------
self.display_param = tu.DisplayParametersFrame(self.main_frame, 'High-symmetry K-points', 'Energy', self.bfpp)
self.display_param.frame.grid(row=3, column=0, pady=3, sticky='nsew')
# --------------------------------------------------- BUTTONS --------------------------------------------------
buttons_frame = tkinter.ttk.Frame(self.main_frame)
buttons_frame.grid(pady=3, sticky='nsew')
tkinter.ttk.Button(buttons_frame, text='Apply', command=self.save).grid(row=0, column=0, padx=5)
tkinter.ttk.Button(buttons_frame, text='OK', command=lambda: self.save(close=True)).grid(row=0, column=1, padx=5)
tkinter.ttk.Button(buttons_frame, text='Cancel', command=self.destroy).grid(row=0, column=2, padx=5)
def __init__(self, mainwindow, material_study):
tk.Toplevel.__init__(self, mainwindow)
self.mainwindow = mainwindow
self.material_study = material_study
self.cpp = material_study.cpp
self.main_frame = ttk.Frame(self)
self.main_frame.grid(sticky='nsew')
self.main_frame.grid_columnconfigure(0, weight=1)
self.title(material_study.treetitle +
' Defect Concentrations Plot Parameters Window')
# --------------------------------------------- EFFECTIVE MASSE --------------------------------------------------
label0 = tk.Label(self.main_frame,
text='Charge Carriers Effective Masses',
font='-weight bold')
masses_frame = ttk.LabelFrame(self.main_frame, labelwidget=label0)
masses_frame.grid(sticky='nsew')
self.m_e_entry = tu.QuantityEntry(masses_frame,
'Electrons effective mass',
self.cpp.m_e,
' me',
width=5)
self.m_e_entry.pack(padx=5, pady=5)
self.m_h_entry = tu.QuantityEntry(masses_frame,
'Holes effective mass',
self.cpp.m_h,
' me',
width=5)
self.m_h_entry.pack(padx=5, pady=5)
# --------------------------------------------- TEMPERATURES --------------------------------------------------
label1 = tk.Label(self.main_frame,
text='Temperatures',
font='-weight bold')
temperature_frame = ttk.LabelFrame(self.main_frame, labelwidget=label1)
temperature_frame.grid()
tk.Label(temperature_frame,
text='Ambiant Temperature (fixed) ').grid(row=0, column=0)
self.cte_temp = tu.QuantityEntry(temperature_frame,
'',
self.cpp.temperature,
'K',
width=7)
self.cte_temp.grid(row=0, column=1)
self.temp_range = tu.RangeFrame(temperature_frame,
self.cpp.xmin,
self.cpp.xmax,
'Growth Temperature',
'K',
step=self.cpp.dt,
width=7)
self.temp_range.grid(row=1, column=0, columnspan=2, pady=5, padx=5)
# --------------------------------------------- SPECIFIC OPTIONS --------------------------------------------------
self.charge_carriers_var = tk.BooleanVar(
value=self.cpp.charge_carriers)
self.fill_type_var = tk.IntVar(value=self.cpp.fill_type)
label11 = tk.Label(self.main_frame,
text='Specific options',
font='-weight bold')
options_frame = ttk.LabelFrame(self.main_frame, labelwidget=label11)
options_frame.grid(sticky='nsew')
# Display charge carriers
ttk.Checkbutton(
options_frame,
text='Display charge carriers concentrations ',
variable=self.charge_carriers_var,
command=self.set_display_charge_carriers).pack(side='left')
# Fill conductivity type
ttk.Checkbutton(options_frame,
text='Fill conductivity type ',
variable=self.fill_type_var,
command=self.set_fill_type).pack(side='left')
# ---------------------------------------------- DISPLAY PARAMS ------------------------------------------------
self.display_param = tu.DisplayParametersFrame(
self.main_frame, 'Growth Temperature', 'Defect Concentrations',
self.cpp)
self.display_param.frame.grid(row=3, column=0, pady=3, sticky='nsew')
# ---------------------------------------------- COLORS ------------------------------------------------
self.label2 = tk.Label(self.main_frame,
text='Colors',
font='-weight bold')
self.colors_pane = ttk.LabelFrame(self.main_frame,
labelwidget=self.label2)
self.colors = {}
self.labels = {}
self.index = 0
def title(key):
if key in ['n (electrons)', 'n (holes)', 'n type', 'p type']:
return key
else:
return self.material_study.defect_studies[key].treetitle
sort_list = [[key, title(key)] for key in self.cpp.colors.keys()]
sort_list.sort(key=lambda x: x[1])
for key, treetitle in sort_list:
if key in self.cpp.data_id or (key in ['n type', 'p type']
and self.cpp.fill_type):
self.colors[key] = tk.Button(
self.colors_pane,
text='\t\t',
bg=self.cpp.colors[key],
command=lambda port=key: self.set_color(port))
self.colors[key].grid(row=self.index, column=0, sticky='w')
self.labels[key] = tk.Label(self.colors_pane, text=treetitle)
self.labels[key].grid(row=self.index, column=1, sticky='w')
self.index += 1
self.colors_pane.grid(row=4, column=0, pady=3, sticky='nsew')
# --------------------------------------------------- BUTTONS --------------------------------------------------
buttons_frame = ttk.Frame(self.main_frame)
buttons_frame.grid(row=5, column=0, pady=3, sticky='nsew')
ttk.Button(buttons_frame, text='Apply',
command=self.save).grid(row=0, column=0, padx=5)
ttk.Button(buttons_frame,
text='OK',
command=lambda: self.save(close=True)).grid(row=0,
column=1,
padx=5)
ttk.Button(buttons_frame, text='Cancel',
command=self.destroy).grid(row=0, column=2, padx=5)
def __init__(self, mainwindow, material_study):
tk.Toplevel.__init__(self, mainwindow)
self.mainwindow = mainwindow
self.material_study = material_study
self.eftpp = material_study.eftpp
self.main_frame = ttk.Frame(self)
self.main_frame.grid(sticky='nsew')
self.main_frame.grid_columnconfigure(0, weight=1)
self.title(material_study.treetitle +
' Fermi Level Variations Plot Parameters Window')
# --------------------------------------------- EFFECTIVE MASSE --------------------------------------------------
label0 = tk.Label(self.main_frame,
text='Charge Carriers Effective Masses',
font='-weight bold')
masses_frame = ttk.LabelFrame(self.main_frame, labelwidget=label0)
masses_frame.grid(sticky='nsew')
self.m_e_entry = tu.QuantityEntry(masses_frame,
'Electrons effective mass',
self.eftpp.m_e,
' me',
width=5)
self.m_e_entry.pack(padx=5, pady=5)
self.m_h_entry = tu.QuantityEntry(masses_frame,
'Holes effective mass',
self.eftpp.m_h,
' me',
width=5)
self.m_h_entry.pack(padx=5, pady=5)
# --------------------------------------------- TEMPERATURES --------------------------------------------------
label1 = tk.Label(self.main_frame,
text='Temperatures',
font='-weight bold')
temperature_frame = ttk.LabelFrame(self.main_frame, labelwidget=label1)
temperature_frame.grid()
tk.Label(temperature_frame,
text='Growth Temperature (fixed) ').grid(row=0, column=0)
self.cte_temp = tu.QuantityEntry(temperature_frame,
'',
self.eftpp.temperature,
'K',
width=7)
self.cte_temp.grid(row=0, column=1)
self.temp_range = tu.RangeFrame(temperature_frame,
self.eftpp.xmin,
self.eftpp.xmax,
'Ambiant Temperature',
'K',
step=self.eftpp.dt,
width=7)
self.temp_range.grid(row=1, column=0, columnspan=2, pady=5, padx=5)
# Display parameters
# ---------------------------------------------- DISPLAY PARAMS ------------------------------------------------
self.display_param = tu.DisplayParametersFrame(
self.main_frame, 'Ambiant Temperature',
'Charge Carriers Concentrations', self.eftpp)
self.display_param.frame.grid(row=2, column=0, pady=3, sticky='nsew')
# --------------------------------------------------- BUTTONS --------------------------------------------------
buttons_frame = ttk.Frame(self.main_frame)
buttons_frame.grid(row=5, column=0, pady=3, sticky='nsew')
ttk.Button(buttons_frame, text='Apply',
command=self.save).grid(row=0, column=0, padx=5)
ttk.Button(buttons_frame,
text='OK',
command=lambda: self.save(close=True)).grid(row=0,
column=1,
padx=5)
ttk.Button(buttons_frame, text='Cancel',
command=self.destroy).grid(row=0, column=2, padx=5)
def __init__(self, parent, material_study, fpp):
tk.Toplevel.__init__(self, parent)
self.material_study = material_study
self.fpp = fpp
self.main_frame = ttk.Frame(self)
self.main_frame.pack(expand=True, fill='both')
self.main_frame.grid_columnconfigure(0, weight=1)
ttk.Label(self.main_frame,
text=material_study.treetitle,
font='-weight bold -size 30').grid(padx=20, pady=20)
# Energy range
self.e_range = tu.RangeFrame(self.main_frame,
fpp.energy_range[0],
fpp.energy_range[1],
'Fermi energy',
'eV',
width=7)
self.e_range.grid(sticky=W, padx=5, pady=5)
# Transition levels highlight
self.tr_levels_var = tk.BooleanVar(value=fpp.highlight_charge_change)
ttk.Checkbutton(self.main_frame,
text='Highlight transition levels',
onvalue=True,
offvalue=False,
var=self.tr_levels_var).grid(sticky=W, padx=5, pady=5)
# Charge display
self.charge_display_var = tk.BooleanVar(value=fpp.display_charges)
ttk.Checkbutton(self.main_frame,
text='Show charges',
onvalue=True,
offvalue=False,
var=self.charge_display_var).grid(sticky=W,
padx=5,
pady=5)
# Colors
self.color_choice = None
ttk.Button(self.main_frame,
text='Colours',
command=self.open_color_choice).grid(sticky=W,
padx=5,
pady=5)
# Gap legend display
self.gap_var = tk.BooleanVar(value=fpp.display_gaps_legend)
ttk.Checkbutton(self.main_frame,
text='Show charges',
onvalue=True,
offvalue=False,
var=self.gap_var).grid(sticky=W, padx=5, pady=5)
# --------------------------------------------------- BUTTONS --------------------------------------------------
buttons_frame = ttk.Frame(self.main_frame)
buttons_frame.grid(pady=5, padx=5)
ttk.Button(buttons_frame, text='OK',
command=self.validate).pack(side='left', padx=5)
ttk.Button(buttons_frame, text='Cancel',
command=self.destroy).pack(side='left', padx=5)