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<title>bond_style hybrid command — LAMMPS 15 May 2015 version documentation</title>
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<li>bond_style hybrid command</li>
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<div class="section" id="bond-style-hybrid-command">
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<span id="index-0"></span><h1>bond_style hybrid command<a class="headerlink" href="#bond-style-hybrid-command" title="Permalink to this headline">¶</a></h1>
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<div class="section" id="syntax">
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<h2>Syntax<a class="headerlink" href="#syntax" title="Permalink to this headline">¶</a></h2>
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<div class="highlight-python"><div class="highlight"><pre>bond_style hybrid style1 style2 ...
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</pre></div>
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</div>
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<ul class="simple">
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<li>style1,style2 = list of one or more bond styles</li>
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</ul>
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</div>
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<div class="section" id="examples">
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<h2>Examples<a class="headerlink" href="#examples" title="Permalink to this headline">¶</a></h2>
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<div class="highlight-python"><div class="highlight"><pre>bond_style hybrid harmonic fene
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bond_coeff 1 harmonic 80.0 1.2
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bond_coeff 2* fene 30.0 1.5 1.0 1.0
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</pre></div>
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</div>
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<div class="section" id="description">
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<h2>Description<a class="headerlink" href="#description" title="Permalink to this headline">¶</a></h2>
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<p>The <em>hybrid</em> style enables the use of multiple bond styles in one
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simulation. A bond style is assigned to each bond type. For example,
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bonds in a polymer flow (of bond type 1) could be computed with a
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<em>fene</em> potential and bonds in the wall boundary (of bond type 2) could
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be computed with a <em>harmonic</em> potential. The assignment of bond type
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to style is made via the <a class="reference internal" href="bond_coeff.html"><em>bond_coeff</em></a> command or in
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the data file.</p>
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<p>In the bond_coeff commands, the name of a bond style must be added
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after the bond type, with the remaining coefficients being those
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appropriate to that style. In the example above, the 2 bond_coeff
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commands set bonds of bond type 1 to be computed with a <em>harmonic</em>
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potential with coefficients 80.0, 1.2 for K, r0. All other bond types
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(2-N) are computed with a <em>fene</em> potential with coefficients 30.0,
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1.5, 1.0, 1.0 for K, R0, epsilon, sigma.</p>
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<p>If bond coefficients are specified in the data file read via the
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<a class="reference internal" href="read_data.html"><em>read_data</em></a> command, then the same rule applies.
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E.g. “harmonic” or “fene” must be added after the bond type, for each
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line in the “Bond Coeffs” section, e.g.</p>
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<div class="highlight-python"><div class="highlight"><pre>Bond Coeffs
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</pre></div>
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</div>
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<div class="highlight-python"><div class="highlight"><pre>1 harmonic 80.0 1.2
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2 fene 30.0 1.5 1.0 1.0
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...
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</pre></div>
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</div>
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<p>A bond style of <em>none</em> with no additional coefficients can be used in
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place of a bond style, either in a input script bond_coeff command or
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in the data file, if you desire to turn off interactions for specific
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bond types.</p>
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</div>
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<hr class="docutils" />
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<div class="section" id="restrictions">
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<h2>Restrictions<a class="headerlink" href="#restrictions" title="Permalink to this headline">¶</a></h2>
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<p>This bond style can only be used if LAMMPS was built with the
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MOLECULE package (which it is by default). See the <a class="reference internal" href="Section_start.html#start-3"><span>Making LAMMPS</span></a> section for more info on packages.</p>
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<p>Unlike other bond styles, the hybrid bond style does not store bond
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coefficient info for individual sub-styles in a <a class="reference internal" href="restart.html"><em>binary restart files</em></a>. Thus when retarting a simulation from a restart
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file, you need to re-specify bond_coeff commands.</p>
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</div>
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<div class="section" id="related-commands">
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<h2>Related commands<a class="headerlink" href="#related-commands" title="Permalink to this headline">¶</a></h2>
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<p><a class="reference internal" href="bond_coeff.html"><em>bond_coeff</em></a>, <a class="reference internal" href="delete_bonds.html"><em>delete_bonds</em></a></p>
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<p><strong>Default:</strong> none</p>
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