deploy: d4d615d

Author: simongravelle

sphinx/build/doctrees/environment.pickle

@@ -190,7 +190,7 @@ types.  By default, LAMMPS calculates the pair coefficients for the
 interactions between atoms of different types (i and j) by using
 geometric average: :math:`\epsilon_{ij} = \sqrt{\epsilon_{ii} \epsilon_{jj}}`,
 :math:`\sigma_{ij} = \sqrt{\sigma_{ii} \sigma_{jj}}`.  However, if the default
-value of :math:`5.941\,\text{kcal/mol}` was used for :math:`\epsilon_\text{1-5}`,
+value of :math:`1.472\,\text{kcal/mol}` was used for :math:`\epsilon_\text{1-5}`,
 the solid walls would be extremely hydrophilic, causing the water
 molecules to form dense layers.  As a comparison, the water-water energy
 :math:`\epsilon_\text{1-1}` is only :math:`0.185199\,\text{kcal/mol}`.  Therefore,

sphinx/build/doctrees/tutorial4/nanosheared-electrolyte.doctree

@@ -459,7 +459,7 @@ <h3>System generation<a class="headerlink" href="#system-generation" title="Link
 interactions between atoms of different types (i and j) by using
 geometric average: <span class="math notranslate nohighlight">\(\epsilon_{ij} = \sqrt{\epsilon_{ii} \epsilon_{jj}}\)</span>,
 <span class="math notranslate nohighlight">\(\sigma_{ij} = \sqrt{\sigma_{ii} \sigma_{jj}}\)</span>.  However, if the default
-value of <span class="math notranslate nohighlight">\(5.941\,\text{kcal/mol}\)</span> was used for <span class="math notranslate nohighlight">\(\epsilon_\text{1-5}\)</span>,
+value of <span class="math notranslate nohighlight">\(1.472\,\text{kcal/mol}\)</span> was used for <span class="math notranslate nohighlight">\(\epsilon_\text{1-5}\)</span>,
 the solid walls would be extremely hydrophilic, causing the water
 molecules to form dense layers.  As a comparison, the water-water energy
 <span class="math notranslate nohighlight">\(\epsilon_\text{1-1}\)</span> is only <span class="math notranslate nohighlight">\(0.185199\,\text{kcal/mol}\)</span>.  Therefore,

sphinx/build/doctrees/tutorial4/tutorial.doctree

@@ -421,7 +421,7 @@ <h2>System generation<a class="headerlink" href="#system-generation" title="Link
 interactions between atoms of different types (i and j) by using
 geometric average: <span class="math notranslate nohighlight">\(\epsilon_{ij} = \sqrt{\epsilon_{ii} \epsilon_{jj}}\)</span>,
 <span class="math notranslate nohighlight">\(\sigma_{ij} = \sqrt{\sigma_{ii} \sigma_{jj}}\)</span>.  However, if the default
-value of <span class="math notranslate nohighlight">\(5.941\,\text{kcal/mol}\)</span> was used for <span class="math notranslate nohighlight">\(\epsilon_\text{1-5}\)</span>,
+value of <span class="math notranslate nohighlight">\(1.472\,\text{kcal/mol}\)</span> was used for <span class="math notranslate nohighlight">\(\epsilon_\text{1-5}\)</span>,
 the solid walls would be extremely hydrophilic, causing the water
 molecules to form dense layers.  As a comparison, the water-water energy
 <span class="math notranslate nohighlight">\(\epsilon_\text{1-1}\)</span> is only <span class="math notranslate nohighlight">\(0.185199\,\text{kcal/mol}\)</span>.  Therefore,

sphinx/build/html/_sources/tutorial4/tutorial.rst.txt

@@ -190,7 +190,7 @@ types.  By default, LAMMPS calculates the pair coefficients for the
 interactions between atoms of different types (i and j) by using
 geometric average: :math:`\epsilon_{ij} = \sqrt{\epsilon_{ii} \epsilon_{jj}}`,
 :math:`\sigma_{ij} = \sqrt{\sigma_{ii} \sigma_{jj}}`.  However, if the default
-value of :math:`5.941\,\text{kcal/mol}` was used for :math:`\epsilon_\text{1-5}`,
+value of :math:`1.472\,\text{kcal/mol}` was used for :math:`\epsilon_\text{1-5}`,
 the solid walls would be extremely hydrophilic, causing the water
 molecules to form dense layers.  As a comparison, the water-water energy
 :math:`\epsilon_\text{1-1}` is only :math:`0.185199\,\text{kcal/mol}`.  Therefore,