Ethane

From SklogWiki
Revision as of 11:35, 9 September 2010 by Carl McBride (talk | contribs) (Started a section on the critical properties.)
Jump to: navigation, search
Simeq0.png This article is a 'stub' page, it has no, or next to no, content. It is here at the moment to help form part of the structure of SklogWiki. If you add sufficient material to this article then please remove the {{Stub-general}} template from this page.


<jmol>

 <jmolApplet>
 <script>set spin X 10; spin on</script>
 <size>200</size>
 <color>lightgrey</color>
   <wikiPageContents>Ethane.pdb</wikiPageContents>
</jmolApplet>
</jmol>
Ethane

Ethane.

Models

The NERD parameters are:

Molecule \sigma_{\mathrm {CH}_3} \sigma_{\mathrm {CH}_2} \epsilon_{\mathrm {CH}_3} \epsilon_{\mathrm {CH}_2}
ethane 3.825 \mathrm{\AA} 3.93 \mathrm{\AA} 100.6 K

Critical properties

The pressure, temperature and density at the critical point have been calculated for a virial equation of state using the TraPPE-UA force field, and are given in Table I of [1].

References