<!DOCTYPE html PUBLIC "-//W3C//DTD XHTML 1.0 Transitional//EN" "http://www.w3.org/TR/xhtml1/DTD/xhtml1-transitional.dtd"> <html xmlns="http://www.w3.org/1999/xhtml"> <head> <meta http-equiv="Content-Type" content="text/xhtml;charset=UTF-8"/> <meta http-equiv="X-UA-Compatible" content="IE=9"/> <title>The Gnome Chemistry Utils: element.h Source File</title> <link href="tabs.css" rel="stylesheet" type="text/css"/> <script type="text/javascript" src="jquery.js"></script> <script type="text/javascript" src="dynsections.js"></script> <link href="doxygen.css" rel="stylesheet" type="text/css" /> </head> <body> <div id="top"><!-- do not remove this div, it is closed by doxygen! --> <div id="titlearea"> <table cellspacing="0" cellpadding="0"> <tbody> <tr style="height: 56px;"> <td style="padding-left: 0.5em;"> <div id="projectname">The Gnome Chemistry Utils  <span id="projectnumber">0.14.2</span> </div> </td> </tr> </tbody> </table> </div> <!-- end header part --> <!-- Generated by Doxygen 1.8.1.2 --> <div id="navrow1" class="tabs"> <ul class="tablist"> <li><a href="index.html"><span>Main Page</span></a></li> <li><a href="namespaces.html"><span>Namespaces</span></a></li> <li><a href="annotated.html"><span>Classes</span></a></li> <li class="current"><a href="files.html"><span>Files</span></a></li> </ul> </div> <div id="navrow2" class="tabs2"> <ul class="tablist"> <li><a href="files.html"><span>File List</span></a></li> <li><a href="globals.html"><span>File Members</span></a></li> </ul> </div> <div id="nav-path" class="navpath"> <ul> <li class="navelem"><a class="el" href="dir_6719ab1f1f7655efc2fa43f7eb574fd1.html">libs</a></li><li class="navelem"><a class="el" href="dir_a58dfd42f88c935731f32d659aed32ec.html">gcu</a></li> </ul> </div> </div><!-- top --> <div class="header"> <div class="headertitle"> <div class="title">element.h</div> </div> </div><!--header--> <div class="contents"> <a href="element_8h.html">Go to the documentation of this file.</a><div class="fragment"><div class="line"><a name="l00001"></a><span class="lineno"> 1</span> <span class="comment">// -*- C++ -*-</span></div> <div class="line"><a name="l00002"></a><span class="lineno"> 2</span> </div> <div class="line"><a name="l00003"></a><span class="lineno"> 3</span> <span class="comment">/*</span></div> <div class="line"><a name="l00004"></a><span class="lineno"> 4</span> <span class="comment"> * Gnome Chemistry Utils</span></div> <div class="line"><a name="l00005"></a><span class="lineno"> 5</span> <span class="comment"> * element.h</span></div> <div class="line"><a name="l00006"></a><span class="lineno"> 6</span> <span class="comment"> *</span></div> <div class="line"><a name="l00007"></a><span class="lineno"> 7</span> <span class="comment"> * Copyright (C) 2002-2012 Jean Bréfort <jean.brefort@normalesup.org></span></div> <div class="line"><a name="l00008"></a><span class="lineno"> 8</span> <span class="comment"> *</span></div> <div class="line"><a name="l00009"></a><span class="lineno"> 9</span> <span class="comment"> * This program is free software; you can redistribute it and/or</span></div> <div class="line"><a name="l00010"></a><span class="lineno"> 10</span> <span class="comment"> * modify it under the terms of the GNU General Public License as</span></div> <div class="line"><a name="l00011"></a><span class="lineno"> 11</span> <span class="comment"> * published by the Free Software Foundation; either version 3 of the</span></div> <div class="line"><a name="l00012"></a><span class="lineno"> 12</span> <span class="comment"> * License, or (at your option) any later version.</span></div> <div class="line"><a name="l00013"></a><span class="lineno"> 13</span> <span class="comment"> *</span></div> <div class="line"><a name="l00014"></a><span class="lineno"> 14</span> <span class="comment"> * This program is distributed in the hope that it will be useful,</span></div> <div class="line"><a name="l00015"></a><span class="lineno"> 15</span> <span class="comment"> * but WITHOUT ANY WARRANTY; without even the implied warranty of</span></div> <div class="line"><a name="l00016"></a><span class="lineno"> 16</span> <span class="comment"> * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the</span></div> <div class="line"><a name="l00017"></a><span class="lineno"> 17</span> <span class="comment"> * GNU General Public License for more details.</span></div> <div class="line"><a name="l00018"></a><span class="lineno"> 18</span> <span class="comment"> *</span></div> <div class="line"><a name="l00019"></a><span class="lineno"> 19</span> <span class="comment"> * You should have received a copy of the GNU General Public License</span></div> <div class="line"><a name="l00020"></a><span class="lineno"> 20</span> <span class="comment"> * along with this program; if not, write to the Free Software</span></div> <div class="line"><a name="l00021"></a><span class="lineno"> 21</span> <span class="comment"> * Foundation, Inc., 51 Franklin St, Fifth Floor, Boston, MA 02110-1301</span></div> <div class="line"><a name="l00022"></a><span class="lineno"> 22</span> <span class="comment"> * USA</span></div> <div class="line"><a name="l00023"></a><span class="lineno"> 23</span> <span class="comment"> */</span></div> <div class="line"><a name="l00024"></a><span class="lineno"> 24</span> </div> <div class="line"><a name="l00025"></a><span class="lineno"> 25</span> <span class="preprocessor">#ifndef GCU_ELEMENT_H</span></div> <div class="line"><a name="l00026"></a><span class="lineno"> 26</span> <span class="preprocessor"></span><span class="preprocessor">#define GCU_ELEMENT_H</span></div> <div class="line"><a name="l00027"></a><span class="lineno"> 27</span> <span class="preprocessor"></span></div> <div class="line"><a name="l00028"></a><span class="lineno"> 28</span> <span class="preprocessor">#include <map></span></div> <div class="line"><a name="l00029"></a><span class="lineno"> 29</span> <span class="preprocessor">#include <string></span></div> <div class="line"><a name="l00030"></a><span class="lineno"> 30</span> <span class="preprocessor">#include <vector></span></div> <div class="line"><a name="l00031"></a><span class="lineno"> 31</span> <span class="preprocessor">#include "<a class="code" href="chemistry_8h.html">chemistry.h</a>"</span></div> <div class="line"><a name="l00032"></a><span class="lineno"> 32</span> <span class="preprocessor">#include "<a class="code" href="isotope_8h.html">isotope.h</a>"</span></div> <div class="line"><a name="l00033"></a><span class="lineno"> 33</span> <span class="preprocessor">#include "<a class="code" href="value_8h.html">value.h</a>"</span></div> <div class="line"><a name="l00034"></a><span class="lineno"> 34</span> <span class="preprocessor">#include "<a class="code" href="macros_8h.html">macros.h</a>"</span></div> <div class="line"><a name="l00035"></a><span class="lineno"> 35</span> </div> <div class="line"><a name="l00040"></a><span class="lineno"><a class="code" href="element_8h.html#ae675224816189fd1be676df81912ca32"> 40</a></span> <span class="preprocessor">#define GCU_ERROR (1 << (sizeof(int) - 1))</span></div> <div class="line"><a name="l00041"></a><span class="lineno"> 41</span> <span class="preprocessor"></span></div> <div class="line"><a name="l00047"></a><span class="lineno"> 47</span> <span class="keyword">namespace </span>gcu</div> <div class="line"><a name="l00048"></a><span class="lineno"> 48</span> {</div> <div class="line"><a name="l00049"></a><span class="lineno"> 49</span> </div> <div class="line"><a name="l00050"></a><span class="lineno"> 50</span> <span class="keyword">class </span>EltTable;</div> <div class="line"><a name="l00051"></a><span class="lineno"> 51</span> </div> <div class="line"><a name="l00060"></a><span class="lineno"><a class="code" href="classgcu_1_1Element.html"> 60</a></span> <span class="keyword">class </span><a class="code" href="classgcu_1_1Element.html" title="Chemical element.">Element</a></div> <div class="line"><a name="l00061"></a><span class="lineno"> 61</span> {</div> <div class="line"><a name="l00062"></a><span class="lineno"> 62</span> <span class="keyword">friend</span> <span class="keyword">class </span>EltTable;</div> <div class="line"><a name="l00063"></a><span class="lineno"> 63</span> <span class="keyword">private</span>:</div> <div class="line"><a name="l00070"></a><span class="lineno"> 70</span>  <a class="code" href="classgcu_1_1Element.html" title="Chemical element.">Element</a> (<span class="keywordtype">int</span> <a class="code" href="classgcu_1_1Element.html#a254b856b6197cada3e618e72071808a3">Z</a>, <span class="keyword">const</span> <span class="keywordtype">char</span>* <a class="code" href="classgcu_1_1Element.html#a8f7449c846d9da30aafb6e61b5e6e147">Symbol</a>);</div> <div class="line"><a name="l00074"></a><span class="lineno"> 74</span>  <span class="keyword">virtual</span> ~<a class="code" href="classgcu_1_1Element.html" title="Chemical element.">Element</a> ();</div> <div class="line"><a name="l00075"></a><span class="lineno"> 75</span> </div> <div class="line"><a name="l00076"></a><span class="lineno"> 76</span> <span class="keyword">public</span>:</div> <div class="line"><a name="l00081"></a><span class="lineno"> 81</span>  <span class="keyword">static</span> <span class="keyword">const</span> <span class="keywordtype">char</span>* <a class="code" href="classgcu_1_1Element.html#a8f7449c846d9da30aafb6e61b5e6e147">Symbol</a> (<span class="keywordtype">int</span> Z);</div> <div class="line"><a name="l00089"></a><span class="lineno"> 89</span>  <span class="keyword">static</span> <span class="keywordtype">bool</span> <a class="code" href="classgcu_1_1Element.html#ab063c158b35d3ce62cd09969985b405b">BestSide</a> (<span class="keywordtype">int</span> Z);</div> <div class="line"><a name="l00094"></a><span class="lineno"> 94</span>  <span class="keyword">static</span> <span class="keywordtype">int</span> <a class="code" href="classgcu_1_1Element.html#a254b856b6197cada3e618e72071808a3">Z</a> (<span class="keyword">const</span> <span class="keywordtype">char</span>* symbol);</div> <div class="line"><a name="l00099"></a><span class="lineno"> 99</span>  <span class="keyword">static</span> <a class="code" href="classgcu_1_1Element.html" title="Chemical element.">Element</a>* <a class="code" href="classgcu_1_1Element.html#a47e2c8ff9920448eab19d344df2075a7">GetElement</a> (<span class="keywordtype">int</span> Z);</div> <div class="line"><a name="l00104"></a><span class="lineno"> 104</span>  <span class="keyword">static</span> <a class="code" href="classgcu_1_1Element.html" title="Chemical element.">Element</a>* <a class="code" href="classgcu_1_1Element.html#a47e2c8ff9920448eab19d344df2075a7">GetElement</a> (<span class="keyword">const</span> <span class="keywordtype">char</span>* symbol);</div> <div class="line"><a name="l00121"></a><span class="lineno"> 121</span>  <span class="keyword">static</span> <span class="keywordtype">bool</span> <a class="code" href="classgcu_1_1Element.html#ad2a7a0e9cf8c5ec2650cb9d6ddf23ccc">GetRadius</a> (<a class="code" href="structGcuAtomicRadius.html">GcuAtomicRadius</a>* radius);</div> <div class="line"><a name="l00137"></a><span class="lineno"> 137</span>  <span class="keyword">static</span> <span class="keywordtype">bool</span> <a class="code" href="classgcu_1_1Element.html#a2c49b4f62cbd78f169354d70498d226a">GetElectronegativity</a> (<a class="code" href="structGcuElectronegativity.html">GcuElectronegativity</a>* en);</div> <div class="line"><a name="l00145"></a><span class="lineno"> 145</span>  <span class="keyword">static</span> <span class="keywordtype">unsigned</span> <a class="code" href="classgcu_1_1Element.html#aeaf3f7c39a8f163d07ebc047000bf988">GetMaxBonds</a> (<span class="keywordtype">int</span> Z);</div> <div class="line"><a name="l00149"></a><span class="lineno"> 149</span>  <span class="keyword">static</span> <span class="keywordtype">void</span> <a class="code" href="classgcu_1_1Element.html#acb2454d739e364fc9ad3abdc01743fdc">LoadRadii</a> ();</div> <div class="line"><a name="l00153"></a><span class="lineno"> 153</span>  <span class="keyword">static</span> <span class="keywordtype">void</span> <a class="code" href="classgcu_1_1Element.html#aac914bd5ff06da84cc36087c2d1ada63">LoadElectronicProps</a> ();</div> <div class="line"><a name="l00157"></a><span class="lineno"> 157</span>  <span class="keyword">static</span> <span class="keywordtype">void</span> <a class="code" href="classgcu_1_1Element.html#a2447f0c9b984eb548f8dc12efd84c8fa">LoadIsotopes</a> ();</div> <div class="line"><a name="l00161"></a><span class="lineno"> 161</span>  <span class="keyword">static</span> <span class="keywordtype">void</span> <a class="code" href="classgcu_1_1Element.html#ad4c3a78084183f2be4a095cbf1fad6d4">LoadBODR</a> ();</div> <div class="line"><a name="l00165"></a><span class="lineno"> 165</span>  <span class="keyword">static</span> <span class="keywordtype">void</span> <a class="code" href="classgcu_1_1Element.html#ab487fe137a9bfd0b92cd9423972acc45">LoadAllData</a> ();</div> <div class="line"><a name="l00170"></a><span class="lineno"> 170</span>  <span class="keyword">static</span> <span class="keywordtype">void</span> <a class="code" href="classgcu_1_1Element.html#a4e1615d653149e16dd394cd29b1cea00">Init</a> ();</div> <div class="line"><a name="l00171"></a><span class="lineno"> 171</span> </div> <div class="line"><a name="l00175"></a><span class="lineno"><a class="code" href="classgcu_1_1Element.html#a6784952e6d7f6243869fbf227e3e8edf"> 175</a></span>  <span class="keywordtype">int</span> <a class="code" href="classgcu_1_1Element.html#a6784952e6d7f6243869fbf227e3e8edf">GetZ</a> () {<span class="keywordflow">return</span> m_Z;}</div> <div class="line"><a name="l00179"></a><span class="lineno"><a class="code" href="classgcu_1_1Element.html#a69db53b2fdf6000f9e0cff4a6f312d77"> 179</a></span>  <span class="keyword">const</span> <span class="keywordtype">char</span>* <a class="code" href="classgcu_1_1Element.html#a69db53b2fdf6000f9e0cff4a6f312d77">GetSymbol</a> () {<span class="keywordflow">return</span> m_Symbol;}</div> <div class="line"><a name="l00184"></a><span class="lineno"><a class="code" href="classgcu_1_1Element.html#a4eab878848fc2297c8d738b43af1f09a"> 184</a></span>  <span class="keywordtype">char</span> <a class="code" href="classgcu_1_1Element.html#a4eab878848fc2297c8d738b43af1f09a">GetDefaultValence</a> () {<span class="keywordflow">return</span> m_DefaultValence;}</div> <div class="line"><a name="l00190"></a><span class="lineno"><a class="code" href="classgcu_1_1Element.html#aeaf3f7c39a8f163d07ebc047000bf988"> 190</a></span>  <span class="keywordtype">unsigned</span> <a class="code" href="classgcu_1_1Element.html#aeaf3f7c39a8f163d07ebc047000bf988">GetMaxBonds</a> () {<span class="keywordflow">return</span> m_MaxBonds;}</div> <div class="line"><a name="l00196"></a><span class="lineno"><a class="code" href="classgcu_1_1Element.html#a70b961d1f0e9050275fbeec902d7e7d1"> 196</a></span>  <span class="keywordtype">bool</span> <a class="code" href="classgcu_1_1Element.html#a70b961d1f0e9050275fbeec902d7e7d1">GetBestSide</a> () {<span class="keywordflow">return</span> m_BestSide;}</div> <div class="line"><a name="l00201"></a><span class="lineno"><a class="code" href="classgcu_1_1Element.html#a0a7e5e2afe5f893a5cd7da8c51c2c424"> 201</a></span>  <span class="keywordtype">double</span>* <a class="code" href="classgcu_1_1Element.html#a0a7e5e2afe5f893a5cd7da8c51c2c424">GetDefaultColor</a> () {<span class="keywordflow">return</span> m_DefaultColor;}</div> <div class="line"><a name="l00205"></a><span class="lineno"><a class="code" href="classgcu_1_1Element.html#a2a2e3d12ce136680b98edf57108e422b"> 205</a></span>  <span class="keyword">const</span> <span class="keywordtype">char</span>* <a class="code" href="classgcu_1_1Element.html#a2a2e3d12ce136680b98edf57108e422b">GetName</a> () {<span class="keywordflow">return</span> name.c_str();}</div> <div class="line"><a name="l00210"></a><span class="lineno"> 210</span>  <span class="keyword">const</span> <a class="code" href="structGcuAtomicRadius.html">GcuAtomicRadius</a>** <a class="code" href="classgcu_1_1Element.html#a7ed68d1496ad6088d71c1a93fd4f6ba2">GetRadii</a> ();</div> <div class="line"><a name="l00215"></a><span class="lineno"> 215</span>  <span class="keyword">const</span> <a class="code" href="structGcuElectronegativity.html">GcuElectronegativity</a>** <a class="code" href="classgcu_1_1Element.html#aedc23af9c3efbc524105cefe52ccd9f7">GetElectronegativities</a> ();</div> <div class="line"><a name="l00219"></a><span class="lineno"><a class="code" href="classgcu_1_1Element.html#ad65ff60bdf26464fc2c1126fa6a9dee8"> 219</a></span>  <span class="keywordtype">unsigned</span> <a class="code" href="classgcu_1_1Element.html#ad65ff60bdf26464fc2c1126fa6a9dee8">GetValenceElectrons</a> () {<span class="keywordflow">return</span> m_nve;}</div> <div class="line"><a name="l00224"></a><span class="lineno"><a class="code" href="classgcu_1_1Element.html#a283e0c1cbbedd280878d11fb0f004727"> 224</a></span>  <span class="keywordtype">unsigned</span> <a class="code" href="classgcu_1_1Element.html#a283e0c1cbbedd280878d11fb0f004727">GetTotalValenceElectrons</a> () {<span class="keywordflow">return</span> m_tve;}</div> <div class="line"><a name="l00229"></a><span class="lineno"><a class="code" href="classgcu_1_1Element.html#ae8d95e1f004a7f6c9be349d015bebb6c"> 229</a></span>  <span class="keywordtype">unsigned</span> <a class="code" href="classgcu_1_1Element.html#ae8d95e1f004a7f6c9be349d015bebb6c">GetMaxValenceElectrons</a> () {<span class="keywordflow">return</span> m_maxve;}</div> <div class="line"><a name="l00233"></a><span class="lineno"> 233</span>  <a class="code" href="classgcu_1_1DimensionalValue.html">DimensionalValue</a> <span class="keyword">const</span> *<a class="code" href="classgcu_1_1Element.html#a1728ccb4308cf1ceead873f9253ef6a1">GetWeight</a> ();</div> <div class="line"><a name="l00240"></a><span class="lineno"> 240</span>  <a class="code" href="classgcu_1_1IsotopicPattern.html">IsotopicPattern</a> *<a class="code" href="classgcu_1_1Element.html#a7ac4e626d3cc3ec059d7cfbcc8f9792b">GetIsotopicPattern</a> (<span class="keywordtype">unsigned</span> natoms);</div> <div class="line"><a name="l00246"></a><span class="lineno"><a class="code" href="classgcu_1_1Element.html#a39aec5aea1fa927b8b7f5fbddba139b9"> 246</a></span>  std::string <span class="keyword">const</span>& <a class="code" href="classgcu_1_1Element.html#a39aec5aea1fa927b8b7f5fbddba139b9">GetElectronicConfiguration</a> () {<span class="keywordflow">return</span> ElecConfig;}</div> <div class="line"><a name="l00250"></a><span class="lineno"><a class="code" href="classgcu_1_1Element.html#add3c9dfd7f879803a3e16c0c74a4909f"> 250</a></span>  std::map<std::string, std::string> <span class="keyword">const</span>& <a class="code" href="classgcu_1_1Element.html#add3c9dfd7f879803a3e16c0c74a4909f">GetNames</a> () {<span class="keywordflow">return</span> names;}</div> <div class="line"><a name="l00256"></a><span class="lineno"> 256</span>  <a class="code" href="structGcuDimensionalValue.html">GcuDimensionalValue</a> <span class="keyword">const</span> *<a class="code" href="classgcu_1_1Element.html#aeff927817d90de4266d39bd5a5ba9b92">GetIonizationEnergy</a> (<span class="keywordtype">unsigned</span> rank = 1);</div> <div class="line"><a name="l00263"></a><span class="lineno"> 263</span>  <a class="code" href="structGcuDimensionalValue.html">GcuDimensionalValue</a> <span class="keyword">const</span> *<a class="code" href="classgcu_1_1Element.html#a9a9982f3e1c96e5716c53def4822935d">GetElectronAffinity</a> (<span class="keywordtype">unsigned</span> rank = 1);</div> <div class="line"><a name="l00270"></a><span class="lineno"> 270</span>  <a class="code" href="classgcu_1_1Value.html">Value</a> <span class="keyword">const</span> *<a class="code" href="classgcu_1_1Element.html#ae859152172f946092941623d1dbd4f84">GetProperty</a> (<span class="keywordtype">char</span> <span class="keyword">const</span> *property_name);</div> <div class="line"><a name="l00277"></a><span class="lineno"> 277</span>  std::string &<a class="code" href="classgcu_1_1Element.html#a564fc6c6641ed0529c5a361fe5b01092">GetStringProperty</a> (<span class="keywordtype">char</span> <span class="keyword">const</span> *property_name);</div> <div class="line"><a name="l00284"></a><span class="lineno"> 284</span>  <span class="keywordtype">int</span> <a class="code" href="classgcu_1_1Element.html#ac302d9f021a4aff6253b272f081b0a5f">GetIntegerProperty</a> (<span class="keywordtype">char</span> <span class="keyword">const</span> *property_name);</div> <div class="line"><a name="l00285"></a><span class="lineno"> 285</span> </div> <div class="line"><a name="l00289"></a><span class="lineno"> 289</span>  <span class="keywordtype">bool</span> <a class="code" href="classgcu_1_1Element.html#a8c35aa35a6acb5ffbc26a641c4c6e8cb">IsMetallic</a> ();</div> <div class="line"><a name="l00290"></a><span class="lineno"> 290</span> </div> <div class="line"><a name="l00291"></a><span class="lineno"> 291</span> <span class="keyword">private</span>:</div> <div class="line"><a name="l00292"></a><span class="lineno"> 292</span>  <span class="keywordtype">unsigned</span> <span class="keywordtype">char</span> m_Z, m_nve, m_tve, m_maxve;</div> <div class="line"><a name="l00293"></a><span class="lineno"> 293</span>  <span class="keywordtype">char</span> m_Symbol[4];</div> <div class="line"><a name="l00294"></a><span class="lineno"> 294</span>  <a class="code" href="classgcu_1_1DimensionalValue.html">DimensionalValue</a> <span class="keyword">const</span> *m_AtomicWeight;</div> <div class="line"><a name="l00295"></a><span class="lineno"> 295</span>  <span class="keywordtype">char</span> m_DefaultValence;</div> <div class="line"><a name="l00296"></a><span class="lineno"> 296</span>  <span class="keywordtype">unsigned</span> <span class="keywordtype">char</span> m_MaxBonds;</div> <div class="line"><a name="l00297"></a><span class="lineno"> 297</span>  <span class="keywordtype">bool</span> m_BestSide, m_Metallic, m_MetallicCached;</div> <div class="line"><a name="l00298"></a><span class="lineno"> 298</span>  <span class="keywordtype">double</span> m_DefaultColor[3];</div> <div class="line"><a name="l00299"></a><span class="lineno"> 299</span>  std::string name;</div> <div class="line"><a name="l00300"></a><span class="lineno"> 300</span>  std::vector<GcuAtomicRadius*> m_radii;</div> <div class="line"><a name="l00301"></a><span class="lineno"> 301</span>  std::vector<GcuElectronegativity*> m_en;</div> <div class="line"><a name="l00302"></a><span class="lineno"> 302</span>  std::vector<Isotope*> m_isotopes;</div> <div class="line"><a name="l00303"></a><span class="lineno"> 303</span>  std::vector<IsotopicPattern*> m_patterns;</div> <div class="line"><a name="l00304"></a><span class="lineno"> 304</span>  std::vector<GcuDimensionalValue> m_ei;</div> <div class="line"><a name="l00305"></a><span class="lineno"> 305</span>  std::vector<GcuDimensionalValue> m_ae;</div> <div class="line"><a name="l00306"></a><span class="lineno"> 306</span>  std::map<std::string, std::string> names;</div> <div class="line"><a name="l00307"></a><span class="lineno"> 307</span>  std::map<std::string, Value*> props;</div> <div class="line"><a name="l00308"></a><span class="lineno"> 308</span>  std::map<std::string, std::string> sprops;</div> <div class="line"><a name="l00309"></a><span class="lineno"> 309</span>  std::map<std::string, int> iprops;</div> <div class="line"><a name="l00310"></a><span class="lineno"> 310</span>  std::string ElecConfig;</div> <div class="line"><a name="l00314"></a><span class="lineno"><a class="code" href="classgcu_1_1Element.html#ad83cad118261bb1e1979f250cb32e1ce"> 314</a></span> <a class="code" href="macros_8h.html#ae59df402113b58e8e28a7898e09a19a2">GCU_RO_PROP</a> (<span class="keywordtype">bool</span>, Stability)</div> <div class="line"><a name="l00315"></a><span class="lineno"> 315</span> };</div> <div class="line"><a name="l00316"></a><span class="lineno"> 316</span> </div> <div class="line"><a name="l00317"></a><span class="lineno"> 317</span> } <span class="comment">// namespace gcu</span></div> <div class="line"><a name="l00318"></a><span class="lineno"> 318</span> </div> <div class="line"><a name="l00319"></a><span class="lineno"> 319</span> <span class="preprocessor">#endif // GCU_ELEMENT_H</span></div> </div><!-- fragment --></div><!-- contents --> <!-- start footer part --> <hr class="footer"/><address class="footer"><small> Generated on Thu Mar 14 2013 17:34:28 for The Gnome Chemistry Utils by  <a href="http://www.doxygen.org/index.html"> <img class="footer" src="doxygen.png" alt="doxygen"/> </a> 1.8.1.2 </small></address> </body> </html>