Structure and Dynamics of Hydrofluorocarbon/Ionic Liquid Mixtures: An Experimental and Molecular Dynamics Study
Published 2022 View Full Article
- Home
- Publications
- Publication Search
- Publication Details
Title
Structure and Dynamics of Hydrofluorocarbon/Ionic Liquid Mixtures: An Experimental and Molecular Dynamics Study
Authors
Keywords
-
Journal
JOURNAL OF PHYSICAL CHEMISTRY B
Volume 126, Issue 41, Pages 8309-8321
Publisher
American Chemical Society (ACS)
Online
2022-10-08
DOI
10.1021/acs.jpcb.2c05787
References
Ask authors/readers for more resources
Related references
Note: Only part of the references are listed.- LAMMPS - A flexible simulation tool for particle-based materials modeling at the atomic, meso, and continuum scales
- (2021) Aidan P. Thompson et al. COMPUTER PHYSICS COMMUNICATIONS
- Machine Learning Directed Optimization of Classical Molecular Modeling Force Fields
- (2021) Bridgette J. Befort et al. Journal of Chemical Information and Modeling
- Experimental investigation on the viscosity of [Hmim][Tf2N] saturated with R1234ze(E) or R1234yf
- (2020) Yao Zhang et al. INTERNATIONAL JOURNAL OF REFRIGERATION-REVUE INTERNATIONALE DU FROID
- Thermodynamic and process modeling of the recovery of R410A compounds with ionic liquids
- (2020) S. Asensio-Delgado et al. INTERNATIONAL JOURNAL OF REFRIGERATION-REVUE INTERNATIONALE DU FROID
- Viscosity and Density of a Polyol Ester Lubricating Oil Saturated with Compressed Hydrofluoroolefin Refrigerants
- (2020) Ana Rita C. Morais et al. JOURNAL OF CHEMICAL AND ENGINEERING DATA
- Phase Equilibria, Diffusivities, and Equation of State Modeling of HFC-32 and HFC-125 in Imidazolium-Based Ionic Liquids for the Separation of R-410A
- (2020) Ana Rita C. Morais et al. INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH
- PyLAT: Python LAMMPS Analysis Tools
- (2019) Michael T. Humbert et al. Journal of Chemical Information and Modeling
- Thermodynamic properties and critical parameters of HFO-1123 and its binary blends with HFC-32 and HFC-134a using molecular simulations
- (2019) Md. Sarwar Alam et al. INTERNATIONAL JOURNAL OF REFRIGERATION-REVUE INTERNATIONALE DU FROID
- Ionic Liquids Can Enable the Recycling of Fluorinated Greenhouse Gases
- (2019) Luiz Fernando Lepre et al. ACS Sustainable Chemistry & Engineering
- Absorption of Fluorinated Greenhouse Gases Using Fluorinated Ionic Liquids
- (2019) Julio E. Sosa et al. INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH
- Viscosity of saturated mixtures of 1-hexyl-3-methyl-imidazolium bis(trifluoromethylsulfonyl)amide with R600a and R152a
- (2019) Yao Zhang et al. JOURNAL OF CHEMICAL THERMODYNAMICS
- (p,ρ,T) data of 1-butyl-3-methylimidazolium hexafluorophosphate
- (2019) Javid Safarov et al. JOURNAL OF CHEMICAL THERMODYNAMICS
- Evaluation and Refinement of the General AMBER Force Field for Nineteen Pure Organic Electrolyte Solvents
- (2018) Yushan Zhang et al. JOURNAL OF CHEMICAL AND ENGINEERING DATA
- Viscosity and self-diffusivity of ionic liquids with compressed hydrofluorocarbons: 1-Hexyl-3-methyl-imidazolium bis(trifluoromethylsulfonyl)amide and 1,1,1,2-tetrafluoroethane
- (2017) Azita Ahosseini et al. FLUID PHASE EQUILIBRIA
- Revisiting OPLS Force Field Parameters for Ionic Liquid Simulations
- (2017) Brian Doherty et al. Journal of Chemical Theory and Computation
- Reliable Viscosity Calculation from Equilibrium Molecular Dynamics Simulations: A Time Decomposition Method
- (2015) Yong Zhang et al. Journal of Chemical Theory and Computation
- The General AMBER Force Field (GAFF) Can Accurately Predict Thermodynamic and Transport Properties of Many Ionic Liquids
- (2015) K. G. Sprenger et al. JOURNAL OF PHYSICAL CHEMISTRY B
- Systematic Investigation of Nitrile Based Ionic Liquids for CO2 Capture: A Combination of Molecular Simulation and ab Initio Calculation
- (2014) Krishna M. Gupta et al. Journal of Physical Chemistry C
- Molecular Simulation Studies on the Vapor–Liquid Phase Equilibria of Binary Mixtures of R-1234yf and R-1234ze(E) with R-32 and CO2
- (2013) Gabriele Raabe JOURNAL OF CHEMICAL AND ENGINEERING DATA
- A Simple AIMD Approach to Derive Atomic Charges for Condensed Phase Simulation of Ionic Liquids
- (2012) Yong Zhang et al. JOURNAL OF PHYSICAL CHEMISTRY B
- Vapor–Liquid Equilibrium Measurements of Difluoromethane + [Emim]OTf, Difluoromethane + [Bmim]OTf, Difluoroethane + [Emim]OTf, and Difluoroethane + [Bmim]OTf Systems
- (2011) Li Dong et al. JOURNAL OF CHEMICAL AND ENGINEERING DATA
- High-pressure volumetric properties of ionic liquids: 1-butyl-3-methylimidazolium tetrafluoroborate, [C4mim][BF4], 1-butyl-3-methylimidazolium methylsulfate [C4mim][MeSO4] and 1-ethyl-3-methylimidazolium ethylsulfate, [C2mim][EtSO4]
- (2011) Dobrochna Matkowska et al. JOURNAL OF MOLECULAR LIQUIDS
- Densities, isobaric expansivities and isothermal compressibilities of the thiocyanate-based ionic liquids at temperatures (298.15–338.15K) and pressures up to 10MPa
- (2011) Marta Królikowska et al. THERMOCHIMICA ACTA
- What is the Origin of the Prepeak in the X-ray Scattering of Imidazolium-Based Room-Temperature Ionic Liquids?
- (2010) Harsha V. R. Annapureddy et al. JOURNAL OF PHYSICAL CHEMISTRY B
- Viscosity of n-alkyl-3-methyl-imidazolium bis(trifluoromethylsulfonyl)amide ionic liquids saturated with compressed CO2
- (2009) Azita Ahosseini et al. FLUID PHASE EQUILIBRIA
- PACKMOL: A package for building initial configurations for molecular dynamics simulations
- (2009) L. Martínez et al. JOURNAL OF COMPUTATIONAL CHEMISTRY
- Viscosity of Imidazolium-Based Ionic Liquids at Elevated Pressures: Cation and Anion Effects
- (2008) Azita Ahosseini et al. INTERNATIONAL JOURNAL OF THERMOPHYSICS
- Thermodynamical and structural properties of imidazolium based ionic liquids from molecular simulation
- (2008) Gabriele Raabe 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 MoreCreate your own webinar
Interested in hosting your own webinar? Check the schedule and propose your idea to the Peeref Content Team.
Create Now