51 The Industrial Fluid Properties Simulation Challenge

Sunday, November 13, 2016: 3:30 PM - 6:00 PM
Plaza A (Hilton San Francisco Union Square)
Description:
Contributions describing entries in the Industrial Fluid Properties Simulation Challenge

Sponsor:
Computational Molecular Science and Engineering Forum

Chair:
Jonathan D. Moore
Email: jmoore2@dow.com

Co-Chair:
Daniel W. Siderius
Email: daniel.siderius@nist.gov


3:30 PM
(51d) Monte Carlo Molecular Simulations of Water/Oil Interfacial Tension at Elevated Temperatures and Pressures
Jingyi Chen, Bai Xue, David B. Harwood, Qile Chen and J. Ilja Siepmann

4:00 PM
(51e) Interfacial Tension Prediction of Water/Oil Mixtures Using Stabilized Density Gradient Theory and Using iSAFT Density Functional Theory
Xiaoqun Mu, Le Wang, Amin Haghmoradi and Walter G. Chapman

4:30 PM
(51f) Prediction of the Water/Oil Interfacial Tension from Molecular Simulations Using the Coarse Grained SAFT-γ Mie Force Field
Carmelo Herdes, Åsmund Ervik, Andres Mejía and Erich A. Müller

5:00 PM
(51g) Industrial Fluid Properties Simulation Collective 9th Challenge
Konstantinos D. Papavasileiou, Othonas A. Moultos and Ioannis G. Economou

5:30 PM
(51c) Announcement of the Champions of the 9th Industrial Fluid Properties Simulation Challenge
Jonathan Moore
See more of this Group/Topical: Computational Molecular Science and Engineering Forum
<< Previous Session | Next Session >>