Changeset 92
- Timestamp:
- Jun 23, 2010 6:41:43 AM (13 years ago)
- File:
-
- 1 edited
Legend:
- Unmodified
- Added
- Removed
-
trunk/GSASIIpwdGUI.py
r91 r92 513 513 ObjId = cellList.index(Obj.GetId()) 514 514 try: 515 if ibrav in [0,1,2]: 516 controls[6] = controls[7] = controls[8] = float(Obj.GetValue()) 517 controls[9] = controls[10] = controls[11] = 90.0 518 elif ibrav in [3,4,5,6]: 519 if ObjId == 0: 520 controls[6] = controls[7] = float(Obj.GetValue()) 521 else: 522 controls[8] = float(Obj.GetValue()) 523 controls[9] = controls[10] = controls[11] = 90.0 524 if ibrav in [3,4]: 525 controls[11] = 120. 526 elif ibrav in [7,8,9,10]: 527 controls[6+ObjId] = float(Obj.GetValue()) 528 controls[9] = controls[10] = controls[11] = 90.0 529 elif ibrav in [11,12]: 530 controls[9] = controls[11] = 90.0 531 if ObjId != 3: 532 controls[6+ObjId] = float(Obj.GetValue()) 533 else: 534 controls[10] = float(Obj.GetValue()) 515 value = max(1.0,float(Obj.GetValue())) 516 except ValueError: 517 if ObjId < 3: #bad cell edge - reset 518 value = controls[6+ObjId] 519 else: #bad angle 520 value = 90. 521 if ibrav in [0,1,2]: 522 controls[6] = controls[7] = controls[8] = value 523 controls[9] = controls[10] = controls[11] = 90.0 524 Obj.SetValue("%.5f"%(controls[6])) 525 elif ibrav in [3,4,5,6]: 526 if ObjId == 0: 527 controls[6] = controls[7] = value 528 Obj.SetValue("%.5f"%(controls[6])) 535 529 else: 536 controls[6+ObjId] = float(Obj.GetValue()) 537 controls[12] = G2lat.calc_V(G2lat.cell2A(controls[6:12])) 538 UpdateUnitCellsGrid(self,data) 539 except ValueError: 540 Pass 530 controls[8] = value 531 Obj.SetValue("%.5f"%(controls[8])) 532 controls[9] = controls[10] = controls[11] = 90.0 533 if ibrav in [3,4]: 534 controls[11] = 120. 535 elif ibrav in [7,8,9,10]: 536 controls[6+ObjId] = value 537 Obj.SetValue("%.5f"%(controls[6+ObjId])) 538 controls[9] = controls[10] = controls[11] = 90.0 539 elif ibrav in [11,12]: 540 controls[9] = controls[11] = 90.0 541 if ObjId != 3: 542 controls[6+ObjId] = value 543 Obj.SetValue("%.5f"%(controls[6+ObjId])) 544 else: 545 controls[10] = value 546 Obj.SetValue("%.3f"%(controls[6+ObjId])) 547 else: 548 controls[6+ObjId] = value 549 if ObjId < 3: 550 Obj.SetValue("%.5f"%(controls[6+ObjId])) 551 else: 552 Obj.SetValue("%.3f"%(controls[6+ObjId])) 553 controls[12] = G2lat.calc_V(G2lat.cell2A(controls[6:12])) 554 volVal.SetValue("%.3f"%(controls[12])) 541 555 542 556 def OnRefineCell(event): … … 675 689 'Tetragonal-I','Tetragonal-P','Orthorhombic-F','Orthorhombic-I','Orthorhombic-C', 676 690 'Orthorhombic-P','Monoclinic-C','Monoclinic-P','Triclinic'] 677 cellGUIlist = [[[0,1,2],4,zip([" Unit cell: a = "," Vol = "],[True,False],[0,0])], 678 [[3,4,5,6],6,zip([" Unit cell: a = "," c = "," Vol = "],[True,True,False],[0,2,0])], 679 [[7,8,9,10],8,zip([" Unit cell: a = "," b = "," c = "," Vol = "],[True,True,True,False],[0,1,2,0])], 680 [[11,12],10,zip([" Unit cell: a = "," b = "," c = "," beta = "," Vol = "],[True,True,True,True,False],[0,1,2,4,0])], 691 cellGUIlist = [[[0,1,2],4,zip([" Unit cell: a = "," Vol = "],["%.5f","%.3f"],[True,False],[0,0])], 692 [[3,4,5,6],6,zip([" Unit cell: a = "," c = "," Vol = "],["%.5f","%.5f","%.3f"],[True,True,False],[0,2,0])], 693 [[7,8,9,10],8,zip([" Unit cell: a = "," b = "," c = "," Vol = "],["%.5f","%.5f","%.5f","%.3f"], 694 [True,True,True,False],[0,1,2,0])], 695 [[11,12],10,zip([" Unit cell: a = "," b = "," c = "," beta = "," Vol = "], 696 ["%.5f","%.5f","%.5f","%.3f","%.3f"],[True,True,True,True,False],[0,1,2,4,0])], 681 697 [[13,],8,zip([" Unit cell: a = "," b = "," c = "," Vol = "," alpha = "," beta = "," gamma = "], 682 [True,True,True,False,True,True,True],[0,1,2,0,3,4,6])]] 698 ["%.5f","%.5f","%.5f","%.3f","%.3f","%.3f","%.3f"], 699 [True,True,True,False,True,True,True],[0,1,2,0,3,4,5])]] 683 700 684 701 self.dataFrame.SetLabel('Unit Cells List') … … 738 755 cellList = [] 739 756 littleSizer = wx.FlexGridSizer(2,useGUI[1],5,5) 740 for txt, ifEdit,Id in useGUI[2]:757 for txt,fmt,ifEdit,Id in useGUI[2]: 741 758 littleSizer.Add(wx.StaticText(self.dataDisplay,label=txt),0,wx.ALIGN_CENTER_VERTICAL) 742 759 if ifEdit: #a,b,c,etc. 743 cellVal = wx.TextCtrl(self.dataDisplay,value=( "%.5f"%(controls[6+Id])),style=wx.TE_PROCESS_ENTER)760 cellVal = wx.TextCtrl(self.dataDisplay,value=(fmt%(controls[6+Id])),style=wx.TE_PROCESS_ENTER) 744 761 cellVal.Bind(wx.EVT_TEXT_ENTER,OnCellChange) 745 762 littleSizer.Add(cellVal,0,wx.ALIGN_CENTER_VERTICAL) 746 763 cellList.append(cellVal.GetId()) 747 764 else: #volume 748 littleSizer.Add(wx.TextCtrl(self.dataDisplay,value=("%.3f"%(controls[12])),style=wx.TE_READONLY),0,wx.ALIGN_CENTER_VERTICAL) 765 volVal = wx.TextCtrl(self.dataDisplay,value=(fmt%(controls[12])),style=wx.TE_READONLY) 766 littleSizer.Add(volVal,0,wx.ALIGN_CENTER_VERTICAL) 749 767 mainSizer.Add(littleSizer,0) 750 768 mainSizer.Layout()
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