AW: Organic Solvent & Water Simulation

From: Norman Geist (norman.geist_at_uni-greifswald.de)
Date: Wed Jun 21 2017 - 02:31:42 CDT

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Somethink like this?

https://www.youtube.com/watch?v=xcMSHy3CqXA <https://www.youtube.com/watch?v=xcMSHy3CqXA&t=19s> &t=19s

Why shouldn’t it be possible?

Von: owner-namd-l_at_ks.uiuc.edu [mailto:owner-namd-l_at_ks.uiuc.edu] Im Auftrag von Oscar Bastidas
Gesendet: Dienstag, 20. Juni 2017 22:15
An: namd-l_at_ks.uiuc.edu
Betreff: namd-l: Organic Solvent & Water Simulation

Hello everyone,

Would somebody please tell me if it is possible to simulate an emulsion system of water and an organic solvent (hexane perhaps?)

Also would you tell me if NAMD can simulate phase transitions such as the hexane flashing off/evaporating off of the aforementioned water/hexane emulsion? Thank you.

Regards,

Oscar Bastidas, Graduate Student

Department of Chemical and Life Science Engineering

Virginia Commonwealth University

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