SAFT-γforce field for the simulation of molecular fluids: 3. Coarse-grained models of benzene and hetero-group models ofn-decylbenzene
Published 2012 View Full Article
- Home
- Publications
- Publication Search
- Publication Details
Title
SAFT-γforce field for the simulation of molecular fluids: 3. Coarse-grained models of benzene and hetero-group models ofn-decylbenzene
Authors
Keywords
-
Journal
MOLECULAR PHYSICS
Volume 110, Issue 11-12, Pages 1189-1203
Publisher
Informa UK Limited
Online
2012-04-02
DOI
10.1080/00268976.2012.662303
References
Ask authors/readers for more resources
Related references
Note: Only part of the references are listed.- Simultaneous prediction of vapour–liquid and liquid–liquid equilibria (VLE and LLE) of aqueous mixtures with the SAFT-γ group contribution approach
- (2011) Vasileios Papaioannou et al. FLUID PHASE EQUILIBRIA
- SAFT-γ Force Field for the Simulation of Molecular Fluids. 1. A Single-Site Coarse Grained Model of Carbon Dioxide
- (2011) Carlos Avendaño et al. JOURNAL OF PHYSICAL CHEMISTRY B
- Determining Force Field Parameters Using a Physically Based Equation of State
- (2011) Thijs van Westen et al. JOURNAL OF PHYSICAL CHEMISTRY B
- Transferable Potentials for Phase Equilibria−Coarse-Grain Description for Linear Alkanes
- (2011) Katie A. Maerzke et al. JOURNAL OF PHYSICAL CHEMISTRY B
- Comparison of United-Atom Potentials for the Simulation of Vapor–Liquid Equilibria and Interfacial Properties of Long-Chainn-Alkanes up ton-C100
- (2011) Erich A. Müller et al. JOURNAL OF PHYSICAL CHEMISTRY B
- Molecular Modeling of Matter: Impact and Prospects in Engineering
- (2010) Keith E. Gubbins et al. INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH
- Coarse-Grained Potential Models for Phenyl-Based Molecules: I. Parametrization Using Experimental Data
- (2010) Russell DeVane et al. JOURNAL OF PHYSICAL CHEMISTRY B
- Comparative atomistic and coarse-grained study of water: What do we lose by coarse-graining?
- (2009) Han Wang et al. EUROPEAN PHYSICAL JOURNAL E
- Multiscale simulation of soft matter systems
- (2009) Christine Peter et al. FARADAY DISCUSSIONS
- Interfacial properties of selected binary mixtures containing n-alkanes
- (2009) Erich A. Müller et al. FLUID PHASE EQUILIBRIA
- Predicting the Phase Behavior of Polymer Systems with the GC-SAFT-VR Approach
- (2009) Yun Peng et al. INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH
- Transferable Coarse Grain Nonbonded Interaction Model for Amino Acids
- (2009) Russell DeVane et al. Journal of Chemical Theory and Computation
- Coarse-grained modeling of soft condensed matter
- (2009) PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Multiscale simulation of soft matter systems – from the atomistic to the coarse-grained level and back
- (2009) Christine Peter et al. Soft Matter
- A generalisation of the SAFT- group contribution method for groups comprising multiple spherical segments
- (2008) Alexandros Lymperiadis et al. FLUID PHASE EQUILIBRIA
- Developing a predictive group-contribution-based SAFT-VR equation of state
- (2008) Yun Peng et al. FLUID PHASE EQUILIBRIA
- Recent Advances and Applications of Statistical Associating Fluid Theory
- (2008) Sugata P. Tan et al. INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH
- Determination of the melting point of hard spheres from direct coexistence simulation methods
- (2008) Eva G. Noya et al. JOURNAL OF CHEMICAL PHYSICS
- The multiscale coarse-graining method. I. A rigorous bridge between atomistic and coarse-grained models
- (2008) W. G. Noid et al. JOURNAL OF CHEMICAL PHYSICS
Publish scientific posters with Peeref
Peeref publishes scientific posters from all research disciplines. Our Diamond Open Access policy means free access to content and no publication fees for authors.
Learn MoreBecome a Peeref-certified reviewer
The Peeref Institute provides free reviewer training that teaches the core competencies of the academic peer review process.
Get Started