Finding correct volume using NVT calculations

Samuel Andermatt samuel.a... at student.ethz.ch
Tue Jun 9 09:14:57 UTC 2015

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You mean you get the same pressure for different volume? What material are 
you simulating? If you know the Bulk modulus of the involved substances you 
could make some guess from the pressure what the actual volume should 
approimately be.
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