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From: |
John Smith <johnson21smith@...24...> |

Date: |
Mon, 12 Jun 2017 18:31:29 -0500 |

Hello,

In the examples given under SRD, the calculation of potential energy for big particles is given as My other question is, I am calculating the vacf and mean square displacement as well using the fixes specifically for group big. Do I need to do this averaging for that as well? This is what I mean:

or can I just calculate that by doing the following:

**Follow-Ups**:**Re: [lammps-users] SRD energy calculations***From:*Steve Plimpton <sjplimp@...24...>

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