<!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: GcuAtomicRadius Struct Reference</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 class="current"><a href="annotated.html"><span>Classes</span></a></li> <li><a href="files.html"><span>Files</span></a></li> </ul> </div> <div id="navrow2" class="tabs2"> <ul class="tablist"> <li><a href="annotated.html"><span>Class List</span></a></li> <li><a href="classes.html"><span>Class Index</span></a></li> <li><a href="hierarchy.html"><span>Class Hierarchy</span></a></li> <li><a href="functions.html"><span>Class Members</span></a></li> </ul> </div> </div><!-- top --> <div class="header"> <div class="summary"> <a href="#pub-attribs">Public Attributes</a> | <a href="structGcuAtomicRadius-members.html">List of all members</a> </div> <div class="headertitle"> <div class="title">GcuAtomicRadius Struct Reference</div> </div> </div><!--header--> <div class="contents"> <p><code>#include <<a class="el" href="chemistry_8h_source.html">chemistry.h</a>></code></p> <table class="memberdecls"> <tr class="heading"><td colspan="2"><h2><a name="pub-attribs"></a> Public Attributes</h2></td></tr> <tr class="memitem:accc306eb13b178b12586ad329632b936"><td class="memItemLeft" align="right" valign="top">unsigned char </td><td class="memItemRight" valign="bottom"><a class="el" href="structGcuAtomicRadius.html#accc306eb13b178b12586ad329632b936">Z</a></td></tr> <tr class="memitem:a9807e2d9b1666b6c8d2a0d08a790d925"><td class="memItemLeft" align="right" valign="top">enum <a class="el" href="chemistry_8h.html#a9727e94d105ee7c3991d6abc884c5501">gcu_radius_type</a> </td><td class="memItemRight" valign="bottom"><a class="el" href="structGcuAtomicRadius.html#a9807e2d9b1666b6c8d2a0d08a790d925">type</a></td></tr> <tr class="memitem:aaa4d71c6b37a0dbbb83b2a324bc191e9"><td class="memItemLeft" align="right" valign="top"><a class="el" href="structGcuDimensionalValue.html">GcuDimensionalValue</a> </td><td class="memItemRight" valign="bottom"><a class="el" href="structGcuAtomicRadius.html#aaa4d71c6b37a0dbbb83b2a324bc191e9">value</a></td></tr> <tr class="memitem:aa01403c7070024b22af961c5fa5b848f"><td class="memItemLeft" align="right" valign="top">char </td><td class="memItemRight" valign="bottom"><a class="el" href="structGcuAtomicRadius.html#aa01403c7070024b22af961c5fa5b848f">charge</a></td></tr> <tr class="memitem:ad5db8d71303f2e9da28f1cef1807478d"><td class="memItemLeft" align="right" valign="top">char const * </td><td class="memItemRight" valign="bottom"><a class="el" href="structGcuAtomicRadius.html#ad5db8d71303f2e9da28f1cef1807478d">scale</a></td></tr> <tr class="memitem:a98145ae3bf6fedffd53614f5bb47d2e3"><td class="memItemLeft" align="right" valign="top">char </td><td class="memItemRight" valign="bottom"><a class="el" href="structGcuAtomicRadius.html#a98145ae3bf6fedffd53614f5bb47d2e3">cn</a></td></tr> <tr class="memitem:a114f2925439ce48588e5e5119fe1cd56"><td class="memItemLeft" align="right" valign="top">enum <a class="el" href="chemistry_8h.html#a22b7c0b822ebadd84b01ed5294e1903d">gcu_spin_state</a> </td><td class="memItemRight" valign="bottom"><a class="el" href="structGcuAtomicRadius.html#a114f2925439ce48588e5e5119fe1cd56">spin</a></td></tr> </table> <a name="details" id="details"></a><h2>Detailed Description</h2> <div class="textblock"><p><a class="el" href="structGcuAtomicRadius.html">GcuAtomicRadius</a> Structure used to describe an atomic radius. </p> <p>Definition at line <a class="el" href="chemistry_8h_source.html#l00134">134</a> of file <a class="el" href="chemistry_8h_source.html">chemistry.h</a>.</p> </div><h2>Member Data Documentation</h2> <a class="anchor" id="aa01403c7070024b22af961c5fa5b848f"></a> <div class="memitem"> <div class="memproto"> <table class="memname"> <tr> <td class="memname">char GcuAtomicRadius::charge</td> </tr> </table> </div><div class="memdoc"> <p>The charge of the atom (or ion). </p> <p>Definition at line <a class="el" href="chemistry_8h_source.html#l00143">143</a> of file <a class="el" href="chemistry_8h_source.html">chemistry.h</a>.</p> </div> </div> <a class="anchor" id="a98145ae3bf6fedffd53614f5bb47d2e3"></a> <div class="memitem"> <div class="memproto"> <table class="memname"> <tr> <td class="memname">char GcuAtomicRadius::cn</td> </tr> </table> </div><div class="memdoc"> <p>the coordination number of the atom or -1 if unknown. </p> <p>Definition at line <a class="el" href="chemistry_8h_source.html#l00147">147</a> of file <a class="el" href="chemistry_8h_source.html">chemistry.h</a>.</p> </div> </div> <a class="anchor" id="ad5db8d71303f2e9da28f1cef1807478d"></a> <div class="memitem"> <div class="memproto"> <table class="memname"> <tr> <td class="memname">char const* GcuAtomicRadius::scale</td> </tr> </table> </div><div class="memdoc"> <p>The scale name, e.g. "Pauling" or "Shannon". </p> <p>Definition at line <a class="el" href="chemistry_8h_source.html#l00145">145</a> of file <a class="el" href="chemistry_8h_source.html">chemistry.h</a>.</p> </div> </div> <a class="anchor" id="a114f2925439ce48588e5e5119fe1cd56"></a> <div class="memitem"> <div class="memproto"> <table class="memname"> <tr> <td class="memname">enum <a class="el" href="chemistry_8h.html#a22b7c0b822ebadd84b01ed5294e1903d">gcu_spin_state</a> GcuAtomicRadius::spin</td> </tr> </table> </div><div class="memdoc"> <p>The spin state (unknown, low or high). </p> <p>Definition at line <a class="el" href="chemistry_8h_source.html#l00149">149</a> of file <a class="el" href="chemistry_8h_source.html">chemistry.h</a>.</p> </div> </div> <a class="anchor" id="a9807e2d9b1666b6c8d2a0d08a790d925"></a> <div class="memitem"> <div class="memproto"> <table class="memname"> <tr> <td class="memname">enum <a class="el" href="chemistry_8h.html#a9727e94d105ee7c3991d6abc884c5501">gcu_radius_type</a> GcuAtomicRadius::type</td> </tr> </table> </div><div class="memdoc"> <p>The radius type (unknown, ionic, metallic, covalent, or van der Waals). </p> <p>Definition at line <a class="el" href="chemistry_8h_source.html#l00139">139</a> of file <a class="el" href="chemistry_8h_source.html">chemistry.h</a>.</p> </div> </div> <a class="anchor" id="aaa4d71c6b37a0dbbb83b2a324bc191e9"></a> <div class="memitem"> <div class="memproto"> <table class="memname"> <tr> <td class="memname"><a class="el" href="structGcuDimensionalValue.html">GcuDimensionalValue</a> GcuAtomicRadius::value</td> </tr> </table> </div><div class="memdoc"> <p>The radius value (the unit should always be pm). </p> <p>Definition at line <a class="el" href="chemistry_8h_source.html#l00141">141</a> of file <a class="el" href="chemistry_8h_source.html">chemistry.h</a>.</p> <p>Referenced by <a class="el" href="gcr_2atom_8h_source.html#l00153">gcr::Atom::r()</a>.</p> </div> </div> <a class="anchor" id="accc306eb13b178b12586ad329632b936"></a> <div class="memitem"> <div class="memproto"> <table class="memname"> <tr> <td class="memname">unsigned char GcuAtomicRadius::Z</td> </tr> </table> </div><div class="memdoc"> <p>The atomic number. </p> <p>Definition at line <a class="el" href="chemistry_8h_source.html#l00137">137</a> of file <a class="el" href="chemistry_8h_source.html">chemistry.h</a>.</p> </div> </div> <hr/>The documentation for this struct was generated from the following file:<ul> <li><a class="el" href="chemistry_8h_source.html">chemistry.h</a></li> </ul> </div><!-- contents --> <!-- start footer part --> <hr class="footer"/><address class="footer"><small> Generated on Thu Mar 14 2013 17:34:29 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>