<html><body><div style="color:#000; background-color:#fff; font-family:times new roman, new york, times, serif;font-size:12pt"><div style="RIGHT: auto"><SPAN style="RIGHT: auto">Dear Xavier,</SPAN></div>
<div style="RIGHT: auto"><SPAN style="RIGHT: auto">Many thanks for your help! I changed TiC.insp file as suggested, however, either "jatom" or "jtype" works at all. I copy the TiC.insp file as following:</SPAN></div>
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<div style="FONT-SIZE: 16px; RIGHT: auto; COLOR: rgb(0,0,0); FONT-STYLE: normal; FONT-FAMILY: times new roman, new york, times, serif; BACKGROUND-COLOR: transparent"><SPAN style="RIGHT: auto">### Figure configuration<BR> 5.0 3.0 # paper offset of plot<BR>10.0 15.0 # xsize,ysize [cm]<BR> 1.0 4 # major ticks, minor ticks<BR> 1.0
1 # character height, font switch<BR> 1.1 0 0 # line width, line switch, color switch<BR>### Data configuration <BR>-13.0 8.0 2 # energy range, energy switch (1:Ry, 2:eV)<BR>1 0.74250 # Fermi switch, Fermi-level (in Ry units)<BR>1
999 # number of bands for heavier plotting 1,1<BR>2 4 0.02 # jatom, jtype, size of heavier plotting</SPAN></div>
<div style="FONT-SIZE: 16px; RIGHT: auto; COLOR: rgb(0,0,0); FONT-STYLE: normal; FONT-FAMILY: times new roman, new york, times, serif; BACKGROUND-COLOR: transparent"><SPAN style="RIGHT: auto"></SPAN> </div>
<div style="FONT-SIZE: 16px; RIGHT: auto; COLOR: rgb(0,0,0); FONT-STYLE: normal; FONT-FAMILY: times new roman, new york, times, serif; BACKGROUND-COLOR: transparent"><SPAN style="RIGHT: auto">Could you please give me further suggestions/comments?</SPAN></div>
<div style="FONT-SIZE: 16px; RIGHT: auto; COLOR: rgb(0,0,0); FONT-STYLE: normal; FONT-FAMILY: times new roman, new york, times, serif; BACKGROUND-COLOR: transparent"><SPAN style="RIGHT: auto"></SPAN> </div>
<div style="FONT-SIZE: 16px; RIGHT: auto; COLOR: rgb(0,0,0); FONT-STYLE: normal; FONT-FAMILY: times new roman, new york, times, serif; BACKGROUND-COLOR: transparent"><SPAN style="RIGHT: auto">Best wishes,</SPAN></div>
<div style="FONT-SIZE: 16px; RIGHT: auto; COLOR: rgb(0,0,0); FONT-STYLE: normal; FONT-FAMILY: times new roman, new york, times, serif; BACKGROUND-COLOR: transparent"><SPAN style="RIGHT: auto"></SPAN> </div>
<div style="FONT-SIZE: 16px; RIGHT: auto; COLOR: rgb(0,0,0); FONT-STYLE: normal; FONT-FAMILY: times new roman, new york, times, serif; BACKGROUND-COLOR: transparent"><SPAN style="RIGHT: auto">Bing</SPAN></div>
<div style="FONT-SIZE: 16px; RIGHT: auto; COLOR: rgb(0,0,0); FONT-STYLE: normal; FONT-FAMILY: times new roman, new york, times, serif; BACKGROUND-COLOR: transparent"><SPAN style="RIGHT: auto"><VAR id=yui-ie-cursor></VAR></SPAN> </div>
<div style="FONT-SIZE: 16px; RIGHT: auto; COLOR: rgb(0,0,0); FONT-STYLE: normal; FONT-FAMILY: times new roman, new york, times, serif; BACKGROUND-COLOR: transparent"><SPAN style="RIGHT: auto"> </div></SPAN>
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<DIV class=hr style="BORDER-RIGHT: #ccc 1px solid; PADDING-RIGHT: 0px; BORDER-TOP: #ccc 1px solid; PADDING-LEFT: 0px; FONT-SIZE: 0px; PADDING-BOTTOM: 0px; MARGIN: 5px 0px; BORDER-LEFT: #ccc 1px solid; LINE-HEIGHT: 0; PADDING-TOP: 0px; BORDER-BOTTOM: #ccc 1px solid; HEIGHT: 0px" readonly="true" contenteditable="false"></DIV><FONT face=Arial size=2><B><SPAN style="FONT-WEIGHT: bold">From:</SPAN></B> Rocquefelte <xavier.rocquefelte@cnrs-imn.fr><BR><B><SPAN style="FONT-WEIGHT: bold">To:</SPAN></B> A Mailing list for WIEN2k users <wien@zeus.theochem.tuwien.ac.at> <BR><B><SPAN style="FONT-WEIGHT: bold">Sent:</SPAN></B> Monday, May 27, 2013 4:55:31 PM<BR><B><SPAN style="FONT-WEIGHT: bold">Subject:</SPAN></B> Re: [Wien] the parameter "jtype" in case.insp for bandstructure seems not working<BR></FONT></DIV>
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<DIV class=yiv1263361962moz-cite-prefix style="RIGHT: auto">You must also change the line switch.<BR><BR>### Figure configuration<BR> 5.0 3.0 # paper offset of plot<BR>10.0 15.0 # xsize,ysize [cm]<BR> 0.50 4 # major ticks, minor ticks<BR> 1.0 1 # character height, font switch<BR> 1.1
<B><BIG>0</BIG></B> 0 # line width,<B> line switch,</B> color switch<BR><BR><BR>Line switch:<BR> 0...dots<BR> 1...lines<BR> 2...lines and open circle<BR> 3...lines and filled circles<BR><BR>Only the line switch 0, 2 and 3 allows to see the projected characters (s, p, d...).<BR><BR>Best Regards<BR><BR>Xavier<BR><BR><BR><BR>Le 5/27/2013 5:41 AM, Bing Zhou a écrit :<BR></DIV>
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<DIV>Dear all,</DIV>
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<DIV>I try to plot bandstructure for my minerals, and I used TiC as an example to get myself familar to the procedure, however, not matter what "jtype" in TiC.insp is, only the total bandstructure was shown instead of p, s or d states I chose<VAR id=yiv1263361962yui-ie-cursor></VAR>. <VAR id=yiv1263361962yui-ie-cursor></VAR>Could you please let me know how to make "jtype" work?</DIV>
<DIV>Thank you in advance!</DIV>
<DIV>Bing</DIV>
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