C6F5-NiPorph · 2 Py SpinDensity: Unterschied zwischen den Versionen

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Zeile 16: Zeile 16:
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       reset;center {0.0 0.0 -1.485949}; rotate z 41.95; rotate y 94.86; rotate z -89.61;
       #isosurface sdp 0.000008 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
       #isosurface sdp 0.000004 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
       #isosurface sdm -0.000008 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
       #isosurface sdm -0.000004 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
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     <text>0.008</text>
     <text>0.004</text>
     <script>
     <script>
         isosurface sdp 0.008 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
         isosurface sdp 0.004 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
         isosurface sdm -0.008 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
         isosurface sdm -0.004 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
     </script>
     </script>
   </item>
   </item>
   <item>
   <item>
     <text>0.0008</text>
     <text>0.0004</text>
     <script>
     <script>
         isosurface sdp 0.0008 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
         isosurface sdp 0.0004 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
         isosurface sdm -0.0008 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
         isosurface sdm -0.0004 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
     </script>
     </script>
   </item>
   </item>
   <item>
   <item>
     <text>0.00008</text>
     <text>0.00004</text>
     <script>
     <script>
         isosurface sdp 0.00008 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
         isosurface sdp 0.00004 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
         isosurface sdm -0.00008 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
         isosurface sdm -0.00004 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
     </script>
     </script>
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   </item>
   <item>
   <item>
     <text>0.000008</text>
     <text>0.000004</text>
     <script>
     <script>
         isosurface sdp 0.000008 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
         isosurface sdp 0.000004 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
         isosurface sdm -0.000008 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
         isosurface sdm -0.000004 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
     </script>
     </script>
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Zeile 57: Zeile 57:
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Zeile 66: Zeile 67:
       set frank false;
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       reset;center {0.0 0.0 -1.3375801}; rotate z 127.6; rotate y 89.49; rotate z -90.03;
       reset;center {0.0 0.0 -1.3375801}; rotate z 127.6; rotate y 89.49; rotate z -90.03;
       #isosurface sdp 0.000008 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd_ruffle.cub";
       #isosurface sdp 0.000004 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd_ruffle.cub";
       #isosurface sdm -0.000008 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd_ruffle.cub";
       #isosurface sdm -0.000004 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd_ruffle.cub";
     </script>
     </script>
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   <item>
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     <text>0.008</text>
     <text>0.004</text>
    <script>
        isosurface sdp 0.004 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
        isosurface sdm -0.004 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
    </script>
  </item>
  <item>
    <text>0.0004</text>
     <script>
     <script>
         isosurface sdp 0.008 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
         isosurface sdp 0.0004 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
         isosurface sdm -0.008 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
         isosurface sdm -0.0004 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
     </script>
     </script>
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   <item>
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     <text>0.0008</text>
     <text>0.00004</text>
     <script>
     <script>
         isosurface sdp 0.0008 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
         isosurface sdp 0.00004 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
         isosurface sdm -0.0008 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
         isosurface sdm -0.00004 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
     </script>
     </script>
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   <item>
   <item>
     <text>0.00008</text>
     <text>0.000004</text>
     <script>
     <script>
         isosurface sdp 0.00008 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
         isosurface sdp 0.000004 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
         isosurface sdm -0.00008 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
         isosurface sdm -0.000004 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
     </script>
     </script>
   </item>
   </item>
   <item>
   <item>
     <text>0.000008</text>
     <text>None</text>
    <checked>true</checked>
     <script>
     <script>
         isosurface sdp 0.000008 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
         isosurface delete;
        isosurface sdm -0.000008 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
     </script>
     </script>
   </item>
   </item>

Version vom 12. März 2010, 15:00 Uhr

Spin Density Plots

1:1

C6F5-NiPorph_py_1zu1_sd.cub C6F5-NiPorph_py_1zu1_sd_ruffle.cub

Datei:C6F5-NiPorph py 1zu1 sd ruffle.cub Datei:C6F5-NiPorph py 1zu1 sd ruffle.cub

<jmol> 

 <jmolApplet>
   <signed>true</signed>
   <size>500</size>
   <urlContents>http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub</urlContents>
   <script>
      set frank false;
      reset;center {0.0 0.0 -1.485949}; rotate z 41.95; rotate y 94.86; rotate z -89.61;
      #isosurface sdp 0.000004 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
      #isosurface sdm -0.000004 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
   </script>
 </jmolApplet>

 <jmolMenu>
 <item>
    <text>0.004</text>
    <script>
       isosurface sdp 0.004 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
       isosurface sdm -0.004 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
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    <text>0.0004</text>
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       isosurface sdp 0.0004 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
       isosurface sdm -0.0004 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
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    <text>0.00004</text>
    <script>
       isosurface sdp 0.00004 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
       isosurface sdm -0.00004 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
    </script>
 </item>
 <item>
    <text>0.000004</text>
    <script>
       isosurface sdp 0.000004 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
       isosurface sdm -0.000004 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
    </script>
 </item>
 <item>
    <text>None</text>
    <checked>true</checked>
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       isosurface delete;
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 <menuHeight>-1</menuHeight>
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   <signed>true</signed>
   <size>500</size>
   <urlContents>http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd_ruffle.cub</urlContents>
   <script>
      set frank false;
      reset;center {0.0 0.0 -1.3375801}; rotate z 127.6; rotate y 89.49; rotate z -90.03;
      #isosurface sdp 0.000004 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd_ruffle.cub";
      #isosurface sdm -0.000004 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd_ruffle.cub";
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 <jmolMenu>
 <item>
    <text>0.004</text>
    <script>
       isosurface sdp 0.004 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
       isosurface sdm -0.004 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
    </script>
 </item>
 <item>
    <text>0.0004</text>
    <script>
       isosurface sdp 0.0004 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
       isosurface sdm -0.0004 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
    </script>
 </item>
 <item>
    <text>0.00004</text>
    <script>
       isosurface sdp 0.00004 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
       isosurface sdm -0.00004 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
    </script>
 </item>
 <item>
    <text>0.000004</text>
    <script>
       isosurface sdp 0.000004 color darkviolet "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
       isosurface sdm -0.000004 color violet    "http://134.245.135.211/mediawiki_upload/niporph_py/C6F5-NiPorph_py_1zu1_sd.cub";
    </script>
 </item>
 <item>
    <text>None</text>
    <checked>true</checked>
    <script>
       isosurface delete;
    </script>
 </item>
 <menuHeight>-1</menuHeight>
 </jmolMenu>

</jmol>

2:1

coplanar

C6F5-NiPorph_py_2zu1_coplanar_sd.cub

Datei:C6F5-NiPorph py 2zu1 coplanar sd.png

orthogonal

C6F5-NiPorph_py_2zu1_orthogonal_sd.cub

Datei:C6F5-NiPorph py 2zu1 orthogonal sd.png

Abgerufen von „http:///mediawiki/index.php?title=C6F5-NiPorph_·_2_Py_SpinDensity&oldid=5992“