lammps/doc/USER/atc/man_electron_integration.html

31 lines
1.8 KiB
HTML

<!DOCTYPE HTML PUBLIC "-//W3C//DTD HTML 4.01 Transitional//EN">
<html><head><meta http-equiv="Content-Type" content="text/html;charset=iso-8859-1">
<title>ATC: fix_modify AtC extrinsic electron_integration</title>
<link href="doxygen.css" rel="stylesheet" type="text/css">
</head><body>
<!-- Generated by Doxygen 1.3.9.1 -->
<h1><a class="anchor" name="man_electron_integration">fix_modify AtC extrinsic electron_integration</a></h1><h2><a class="anchor" name="syntax">
syntax</a></h2>
fix_modify AtC extrinsic electron_integration &lt;integration_type&gt; &lt;num_subcyle_steps(optional)&gt; <br>
<ul>
<li>integration_type (string) = explicit | implicit | steady <br>
</li></ul>
<p>
num_subcycle_steps (int), optional = number of subcycle steps for the electron time integration<h2><a class="anchor" name="examples">
examples</a></h2>
<code> fix_modify AtC extrinsic electron_integration implicit </code> <br>
<code> fix_modify AtC extrinsic electron_integration explicit 100 </code> <br>
<h2><a class="anchor" name="description">
description</a></h2>
Switches between integration scheme for the electron temperature. The number of subcyling steps used to integrate the electron temperature 1 LAMMPS timestep can be manually adjusted to capture fast electron dynamics.<h2><a class="anchor" name="restrictions">
restrictions</a></h2>
For use only with two_temperature type of AtC fix ( see <a class="el" href="man_fix_atc.html">fix atc command</a> ) <br>
<h2><a class="anchor" name="default">
default</a></h2>
implicit<br>
subcycle_steps = 1 <hr size="1"><address style="align: right;"><small>Generated on Mon Aug 17 09:35:16 2009 for ATC by&nbsp;
<a href="http://www.doxygen.org/index.html">
<img src="doxygen.png" alt="doxygen" align="middle" border="0"></a> 1.3.9.1 </small></address>
</body>
</html>