MD in NVE and NVT ensembles; implementing different thermostats

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Tutorial 3

The problem sheet

You can get the problem sheet application_pdf.pnghere (29 KB)Info circle.png. Solutions have to be handed in as a single PDF or on paper until 9th of December.


The corresponding code

This tutorial aims to provide knowledge about Molecular Dynamics simulations in NVE and NVT ensembles. Here we consider two different systems and using three different thermostats we try to provide a constant temperature or a NVT ensemble It is available for download tar.pnghere (570 KB)Info circle.png.