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<h1>AtomForce Struct Reference<br>
<small>
[<a class="el" href="group__Frontend.html">High-level front-end routines</a>]</small>
</h1><!-- doxytag: class="AtomForce" -->Structure to hold atomic forces.
<a href="#_details">More...</a>
<p>
<code>#include <<a class="el" href="routines_8h-source.html">routines.h</a>></code>
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<tr><td colspan="2"><br><h2>Data Fields</h2></td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top">double </td><td class="memItemRight" valign="bottom"><a class="el" href="structAtomForce.html#47afad04ca2d1b29738d78dc37c98dea">ibForce</a> [3]</td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top">double </td><td class="memItemRight" valign="bottom"><a class="el" href="structAtomForce.html#ba89038c6452b30867d136d23228acf5">qfForce</a> [3]</td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top">double </td><td class="memItemRight" valign="bottom"><a class="el" href="structAtomForce.html#094cd21c7c3224429386bd7d51726d0e">dbForce</a> [3]</td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top">double </td><td class="memItemRight" valign="bottom"><a class="el" href="structAtomForce.html#9356ba5e9fdfbd67002a8c753d661d78">sasaForce</a> [3]</td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top">double </td><td class="memItemRight" valign="bottom"><a class="el" href="structAtomForce.html#8bc8bbf4048a316a5a0182a9539795c1">savForce</a> [3]</td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top">double </td><td class="memItemRight" valign="bottom"><a class="el" href="structAtomForce.html#4e7c9dcdf658048ef6ac763f886c037f">wcaForce</a> [3]</td></tr>
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<hr><a name="_details"></a><h2>Detailed Description</h2>
Structure to hold atomic forces.
<p>
<dl class="author" compact><dt><b>Author:</b></dt><dd>Nathan Baker </dd></dl>
<hr><h2>Field Documentation</h2>
<a class="anchor" name="094cd21c7c3224429386bd7d51726d0e"></a><!-- doxytag: member="AtomForce::dbForce" ref="094cd21c7c3224429386bd7d51726d0e" args="[3]" -->
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<td class="memname">double <a class="el" href="structAtomForce.html#094cd21c7c3224429386bd7d51726d0e">AtomForce::dbForce</a>[3] </td>
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<p>
Dielectric boundary force
<p>Referenced by <a class="el" href="routines_8c-source.html#l02583">printElecForce()</a>, and <a class="el" href="routines_8c-source.html#l02347">printForce()</a>.</p>
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<a class="anchor" name="47afad04ca2d1b29738d78dc37c98dea"></a><!-- doxytag: member="AtomForce::ibForce" ref="47afad04ca2d1b29738d78dc37c98dea" args="[3]" -->
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<td class="memname">double <a class="el" href="structAtomForce.html#47afad04ca2d1b29738d78dc37c98dea">AtomForce::ibForce</a>[3] </td>
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<p>
Ion-boundary force
<p>Referenced by <a class="el" href="routines_8c-source.html#l02583">printElecForce()</a>, and <a class="el" href="routines_8c-source.html#l02347">printForce()</a>.</p>
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<a class="anchor" name="ba89038c6452b30867d136d23228acf5"></a><!-- doxytag: member="AtomForce::qfForce" ref="ba89038c6452b30867d136d23228acf5" args="[3]" -->
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<td class="memname">double <a class="el" href="structAtomForce.html#ba89038c6452b30867d136d23228acf5">AtomForce::qfForce</a>[3] </td>
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<p>
Charge-field force
<p>Referenced by <a class="el" href="routines_8c-source.html#l01120">forceMG()</a>, <a class="el" href="routines_8c-source.html#l02583">printElecForce()</a>, and <a class="el" href="routines_8c-source.html#l02347">printForce()</a>.</p>
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<a class="anchor" name="9356ba5e9fdfbd67002a8c753d661d78"></a><!-- doxytag: member="AtomForce::sasaForce" ref="9356ba5e9fdfbd67002a8c753d661d78" args="[3]" -->
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<td class="memname">double <a class="el" href="structAtomForce.html#9356ba5e9fdfbd67002a8c753d661d78">AtomForce::sasaForce</a>[3] </td>
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<p>
SASA force (coupled to gamma)
<p>Referenced by <a class="el" href="routines_8c-source.html#l02816">printApolForce()</a>.</p>
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<a class="anchor" name="8bc8bbf4048a316a5a0182a9539795c1"></a><!-- doxytag: member="AtomForce::savForce" ref="8bc8bbf4048a316a5a0182a9539795c1" args="[3]" -->
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<td class="memname">double <a class="el" href="structAtomForce.html#8bc8bbf4048a316a5a0182a9539795c1">AtomForce::savForce</a>[3] </td>
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<p>
SAV force (coupled to press)
<p>Referenced by <a class="el" href="routines_8c-source.html#l02816">printApolForce()</a>.</p>
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<a class="anchor" name="4e7c9dcdf658048ef6ac763f886c037f"></a><!-- doxytag: member="AtomForce::wcaForce" ref="4e7c9dcdf658048ef6ac763f886c037f" args="[3]" -->
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<td class="memname">double <a class="el" href="structAtomForce.html#4e7c9dcdf658048ef6ac763f886c037f">AtomForce::wcaForce</a>[3] </td>
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<p>
WCA integral force (coupled to bconc)
<p>Referenced by <a class="el" href="routines_8c-source.html#l02816">printApolForce()</a>.</p>
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<hr>The documentation for this struct was generated from the following file:<ul>
<li><a class="el" href="routines_8h-source.html">routines.h</a></ul>
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