2528df0f75
These changes make it unnecessary to copy header files around during the build process, which tends to confuse IDEs and debuggers. The headers which comprise Cantera's external C++ interface are now in the 'include' directory. All of the samples and demos are now in the 'samples' subdirectory.
245 lines
8.2 KiB
Python
245 lines
8.2 KiB
Python
from Tkinter import *
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import re, math
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from Cantera import *
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from Units import temperature, specificEnergy, specificEntropy
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from UnitChooser import UnitVar
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from GraphFrame import Graph
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def testit():
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pass
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class SpeciesInfo(Label):
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def __init__(self,master,phase=None,species=None,**opt):
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Label.__init__(self,master,opt)
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self.sp = species
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self.phase = phase
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self.bind('<Double-1>', self.show)
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self.bind('<Button-3>', self.show)
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self.bind('<Any-Enter>', self.highlight)
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self.bind('<Any-Leave>', self.nohighlight)
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def highlight(self, event=None):
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self.config(fg='yellow')
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def nohighlight(self, event=None):
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self.config(fg='darkblue')
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def show(self, event):
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self.new=Toplevel()
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self.new.title(self.sp.symbol)
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#self.new.transient(self.master)
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self.new.bind("<Return>", self.update,"+")
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self.cpr = 0.0
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self.t = 0.0
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self.cpl = 0.0
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self.tl = 0.0
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self.cpp = [[(0.0, 0.0, 'red')]]
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# elemental composition
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self.eframe = Frame(self.new)
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self.eframe.config(relief=GROOVE,bd=4)
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self.eframe.grid(row=0,column=0,columnspan=10,sticky=E+W)
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r = 1
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Label(self.eframe,text='Atoms:')\
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.grid(row=0,column=0,sticky=N+W)
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for el, c in self.sp.composition():
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Label(self.eframe,text=`int(c)`+' '+el).grid(row=0,column=r)
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r = r + 1
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# thermodynamic properties
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self.thermo = Frame(self.new)
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self.thermo.config(relief=GROOVE,bd=4)
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self.thermo.grid(row=1,column=0,columnspan=10,sticky=N+E+W)
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Label(self.thermo,text = 'Standard Heat of Formation at 298 K: ').grid(row=0, column=0, sticky=W)
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Label(self.thermo,text = '%8.2f kJ/mol' % (self.sp.hf0*1.0e-6)).grid(row=0, column=1, sticky=W)
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Label(self.thermo,text = 'Molar Mass: ').grid(row=1, column=0, sticky=W)
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Label(self.thermo,text = self.sp.molecularWeight).grid(row=1, column=1, sticky=W)
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labels = ['Temperature', 'c_p', 'Enthalpy', 'Entropy']
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units = [temperature, specificEntropy, specificEnergy, specificEntropy]
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whichone = [0, 1, 1, 1]
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r = 2
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self.prop = []
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for prop in labels:
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Label(self.thermo,text=prop).grid(row=r,column=0,sticky=W)
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p = UnitVar(self.thermo,units[r-2],whichone[r-2])
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p.grid(row=r,column=1,sticky=W)
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p.v.config(state=DISABLED,bg='lightgray')
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self.prop.append(p)
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r = r + 1
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tmin = self.sp.minTemp
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tmax = self.sp.maxTemp
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cp = self.sp.cp_R(tmin)
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hh = self.sp.enthalpy_RT(tmin)
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ss = self.sp.entropy_R(tmin)
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self.prop[0].bind("<Any-Enter>", self.decouple)
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self.prop[0].bind("<Any-Leave>", self.update)
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self.prop[0].bind("<Key>", self.update)
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self.prop[0].v.config(state=NORMAL,bg='white')
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self.prop[0].set(300.0)
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self.graphs = Frame(self.new)
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self.graphs.config(relief=GROOVE,bd=4)
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self.graphs.grid(row=2,column=0,columnspan=10,sticky=E+W)
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self.cpdata = []
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self.hdata = []
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self.sdata = []
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t = tmin
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n = int((tmax - tmin)/100.0)
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while t <= tmax:
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self.cpdata.append((t,self.sp.cp_R(t)))
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self.hdata.append((t,self.sp.enthalpy_RT(t)))
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self.sdata.append((t,self.sp.entropy_R(t)))
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t = t + n
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# specific heat
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Label(self.graphs,text='c_p/R').grid(row=0,column=0,sticky=W+E)
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ymin, ymax, dtick = self.plotLimits(self.cpdata)
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self.cpg = Graph(self.graphs,'',tmin,tmax,ymin,ymax,
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pixelX=150,pixelY=150)
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self.cpg.canvas.config(bg='white')
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self.cpg.grid(row=1,column=0,columnspan=2,sticky=W+E)
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self.ticks(ymin, ymax, dtick, tmin, tmax, self.cpg)
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# enthalpy
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Label(self.graphs,text='enthalpy/RT').grid(row=0,column=3,sticky=W+E)
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ymin, ymax, dtick = self.plotLimits(self.hdata)
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self.hg = Graph(self.graphs,'',tmin,tmax,ymin,ymax,
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pixelX=150,pixelY=150)
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self.hg.canvas.config(bg='white')
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self.hg.grid(row=1,column=3,columnspan=2,sticky=W+E)
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self.ticks(ymin, ymax, dtick, tmin, tmax, self.hg)
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# entropy
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Label(self.graphs,text='entropy/R').grid(row=0,column=5,sticky=W+E)
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ymin, ymax, dtick = self.plotLimits(self.sdata)
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self.sg = Graph(self.graphs,'',tmin,tmax,ymin,ymax,
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pixelX=150,pixelY=150)
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self.sg.canvas.config(bg='white')
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self.sg.grid(row=1,column=5,columnspan=2,sticky=W+E)
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self.ticks(ymin, ymax, dtick, tmin, tmax, self.sg)
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n = int((tmax - tmin)/100.0)
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t = tmin
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self.cpp = []
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for t, cp in self.cpdata:
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self.cpg.join([(t,cp,'red')])
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for t, h in self.hdata:
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self.hg.join([(t,h,'green')])
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for t, s in self.sdata:
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self.sg.join([(t,s,'blue')])
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self.cpdot = self.cpg.plot(tmin,cp,'red')
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self.hdot = self.hg.plot(tmin,hh,'green')
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self.sdot = self.sg.plot(tmin,ss,'blue')
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b=Button(self.new,text=' OK ',command=self.finished, default=ACTIVE)
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#ed=Button(self.new,text='Edit',command=testit)
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b.grid(column=0, row=4,sticky=W)
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#ed.grid(column=1,row=4,sticky=W)
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self.scfr = Frame(self.new)
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self.scfr.config(relief=GROOVE,bd=4)
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self.scfr.grid(row=3,column=0,columnspan=10,sticky=N+E+W)
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self.sc = Scale(self.scfr,command=self.update,variable = self.prop[0].x,
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orient='horizontal',digits=7,length=400)
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self.sc.config(cnf={'from':tmin,'to':tmax})
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self.sc.bind('<Any-Enter>',self.couple)
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self.scfr.bind('<Any-Leave>',self.decouple)
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self.sc.grid(row=0,column=0,columnspan=10)
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def decouple(self,event=None):
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d = DoubleVar()
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xx = self.prop[0].get()
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d.set(xx)
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self.sc.config(variable = d)
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def couple(self,event=None):
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self.sc.config(variable = self.prop[0].x)
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#self.update()
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def update(self,event=None):
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try:
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tmp = self.prop[0].get()
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cnd = self.sp.cp_R(tmp)
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cc = cnd*GasConstant
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self.prop[1].set(cc)
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hnd = self.sp.enthalpy_RT(tmp)
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hh = hnd*tmp*GasConstant
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self.prop[2].set(hh)
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snd = self.sp.entropy_R(tmp)
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ss = snd*tmp*GasConstant
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self.prop[3].set(ss)
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self.cppoint = tmp, cnd
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self.hpoint = tmp, hnd
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self.spoint = tmp, snd
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if hasattr(self, 'cpdot'):
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self.cpg.delete(self.cpdot)
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self.cpdot = self.cpg.plot(self.cppoint[0], self.cppoint[1],'red')
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self.hg.delete(self.hdot)
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self.hdot = self.hg.plot(self.hpoint[0], self.hpoint[1],'green')
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self.sg.delete(self.sdot)
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self.sdot = self.sg.plot(self.spoint[0], self.spoint[1],'blue')
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except:
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pass
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def plotLimits(self, xy):
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ymax = -1.e10
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ymin = 1.e10
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for x, y in xy:
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if y > ymax: ymax = y
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if y < ymin: ymin = y
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dy = abs(ymax - ymin)
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if dy < 0.2*ymin:
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ymin = ymin*.9
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ymax = ymax*1.1
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dy = abs(ymax - ymin)
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else:
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ymin = ymin - 0.1*dy
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ymax = ymax + 0.1*dy
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dy = abs(ymax - ymin)
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p10 = math.floor(math.log10(0.1*dy))
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fctr = math.pow(10.0, p10)
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mm = [2.0, 2.5, 2.0]
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i = 0
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while dy/fctr > 5:
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fctr = mm[i % 3]*fctr
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i = i + 1
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ymin = fctr*math.floor(ymin/fctr)
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ymax = fctr*(math.floor(ymax/fctr + 1))
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return (ymin, ymax, fctr)
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def ticks(self, ymin, ymax, dtick, tmin, tmax, plot):
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ytick = ymin
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eps = 1.e-3
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while ytick <= ymax:
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if abs(ytick) < eps:
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plot.join([(tmin, ytick, 'gray')])
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plot.join([(tmax, ytick, 'gray')])
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plot.last_points = []
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else:
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plot.join([(tmin, ytick, 'gray')])
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plot.join([(tmin + 0.05*(tmax - tmin), ytick, 'gray')])
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plot.last_points = []
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plot.join([(2.0*tmax, ytick, 'gray')])
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plot.join([(tmax - 0.05*(tmax - tmin), ytick, 'gray')])
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plot.last_points = []
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ytick = ytick + dtick
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def finished(self,event=None):
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self.new.destroy()
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