Molecular electrostatic potential: Difference between revisions
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New page: The following pdf file describes (1) how to generate the electrostatic molecular potential (MEP) from a VASP calculation, (2) how to plot the MEP on a charge density isosurface using VMD. |
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The following pdf file describes (1) how to generate the electrostatic molecular potential (MEP) from a VASP calculation, (2) how to plot the MEP on a charge density isosurface using VMD. | The following pdf file describes (1) how to generate the electrostatic molecular potential (MEP) from a VASP calculation, (2) how to plot the MEP on a charge density isosurface using VMD. | ||
[http://aliga.iciq.es/wiki/index.php/Image:mep_vmd.pdf file] | |||
Revision as of 11:44, 30 May 2017
The following pdf file describes (1) how to generate the electrostatic molecular potential (MEP) from a VASP calculation, (2) how to plot the MEP on a charge density isosurface using VMD.