Modification of e-CPA for estimating phase equilibria and development of predictive models for electrical conduction in aqueous electrolyte solutions

Determining Ion Activity Coefficients in Ion-Exchange Membranes with Machine Learning and Molecular Dynamics Simulations

(2023) Hishara Keshani Gallage Dona et al.   Industrial & Engineering Chemistry Research

Research progress of cross-linked fiber membranes for lithium-ion battery separators

(2023) Jianhui Deng et al.   CHEMICAL ENGINEERING SCIENCE

Comparisons of equation of state models for electrolytes: e-CPA and e-PPC-SAFT

(2023) Martin Due Olsen et al.   FLUID PHASE EQUILIBRIA

Comparison of Models for the Prediction of the Electrical Conductivity of Electrolyte Solutions

(2022) Saman Naseri Boroujeni et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Accounting for Ionic Strength in the Laliberte–Cooper Density Model for Electrolyte Solutions

(2022) M. N. Mamontov et al.   JOURNAL OF SOLUTION CHEMISTRY

1D multiphysics modelling of PEM water electrolysis anodes with porous transport layers and the membrane

(2022) Nan Lin et al.   CHEMICAL ENGINEERING SCIENCE

A new model for the relative viscosity of aqueous electrolyte solutions

(2022) Hakim Abbasov   CHEMICAL PHYSICS LETTERS

Lanthanum nitrate as aqueous electrolyte additive for favourable zinc metal electrodeposition

(2022) Ruirui Zhao et al.   Nature Communications

An open source COSMO-RS implementation and parameterization supporting the efficient implementation of multiple segment descriptors

(2022) Thomas Gerlach et al.   FLUID PHASE EQUILIBRIA

Effect of Dielectric Saturation on Ion Activity Coefficients in Ion Exchange Membranes

(2022) Akhilesh Paspureddi et al.   ACS Omega

Behavior of the aqueous sodium chloride solutions from molecular simulations and theories

(2022) Jiahuan Tong et al.   JOURNAL OF MOLECULAR LIQUIDS

On the estimation of equivalent conductivity of electrolyte solutions: The effect of relative static permittivity and viscosity

(2022) Saman Naseri Boroujeni et al.   FLUID PHASE EQUILIBRIA

Association‐based activity coefficient model for electrolyte solutions

(2021) Yu‐Jeng Lin et al.   AICHE JOURNAL

ePC-SAFT advanced – Part II: Application to Salt Solubility in Ionic and Organic Solvents and the Impact of Ion Pairing

(2021) Mark Bülow et al.   FLUID PHASE EQUILIBRIA

Effect of Supporting Background Electrolytes on the Nanostructure Morphologies and Electrochemical Behaviors of Electrodeposited Gold Nanoparticles on Glassy Carbon Electrode Surfaces

(2021) Nor Dyana Zakaria et al.   ACS Omega

Utilisation of oxygen from water electrolysis – Assessment for wastewater treatment and aquaculture

(2021) Hossein Mohammadpour et al.   CHEMICAL ENGINEERING SCIENCE

Investigation of the performance of e-CPA for a wide range of properties for aqueous NaCl solutions

(2021) Martin Due Olsen et al.   FLUID PHASE EQUILIBRIA

Modeling of Gas Solubility in Aqueous Electrolyte Solutions with the eSAFT-VR Mie Equation of State

(2021) Nefeli Novak et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Analysis of Some Electrolyte Models including Their Ability to Predict the Activity Coefficients of Individual Ions

(2020) Li Sun et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

A mathematical approach based on the Nernst-Planck equation for the total electric voltage demanded by the electrocoagulation process: Effects of a time-dependent electrical conductivity

(2020) Fernando Rodolfo Espinoza-Quiñones et al.   CHEMICAL ENGINEERING SCIENCE

Electrolyte Solutions for Rechargeable Li-Ion Batteries Based on Fluorinated Solvents

(2020) Ortal Lavi et al.   ACS Applied Energy Materials

Measurement of the Protonic and Electronic Conductivities of PEM Water Electrolyzer Electrodes

(2020) Manas Mandal et al.   ACS Applied Materials & Interfaces

Calculation of thermodynamic equilibria with the predictive electrolyte model COSMO-RS-ES: Improvements for low permittivity systems

(2019) Simon Müller et al.   FLUID PHASE EQUILIBRIA

eCPA: An ion-specific approach to parametrization

(2018) Anders Schlaikjer et al.   FLUID PHASE EQUILIBRIA

Evaluation and refinement of the novel predictive electrolyte model COSMO-RS-ES based on solid-liquid equilibria of salts and Gibbs free energies of transfer of ions

(2018) Simon Müller et al.   FLUID PHASE EQUILIBRIA

Mathematical modelling of surface tension of nanoparticles in electrolyte solutions

(2018) Saheed Olawale Olayiwola et al.   CHEMICAL ENGINEERING SCIENCE

Simultaneous Description of Activity Coefficients and Solubility with eCPA

(2017) Anders Schlaikjer et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Molar Volumes and Heat Capacities of Aqueous Solutions of Potassium Hydroxide and for Water Ionization up to 573 K at 10 MPa

(2017) Lubomir Hnedkovsky et al.   JOURNAL OF CHEMICAL AND ENGINEERING DATA

Accurate Determination of Ion Polarizabilities in Aqueous Solutions

(2017) Minglun Li et al.   JOURNAL OF PHYSICAL CHEMISTRY B

NaCl and KCl effect on (vapour+liquid) equilibrium of binary, ternary and quaternary systems involving water, ethanol and glycerol at low pressures

(2016) Heron Faggion et al.   JOURNAL OF CHEMICAL THERMODYNAMICS

An electrolyte CPA equation of state for mixed solvent electrolytes

(2015) Bjørn Maribo-Mogensen et al.   AICHE JOURNAL

ePC-SAFT revised

(2014) Christoph Held et al.   CHEMICAL ENGINEERING RESEARCH & DESIGN

Electrolyte CPA equation of state for very high temperature and pressure reservoir and basin applications

(2014) Xavier Courtial et al.   GEOCHIMICA ET COSMOCHIMICA ACTA

Solubilities, Vapor Pressures, Densities, Viscosities, and Specific Heat Capacities of the LiNO3/H2O Binary System

(2013) Chunhuan Luo et al.   JOURNAL OF CHEMICAL AND ENGINEERING DATA

Electrical Conductivity of Electrolytes Found In Natural Waters from (5 to 90) °C

(2011) R. Blaine McCleskey   JOURNAL OF CHEMICAL AND ENGINEERING DATA

Experimental determination and prediction of the vapor pressure of some binary and quaternary aqueous solutions of alkaline nitrites and nitrates

(2010) Héctor Galleguillos et al.   FLUID PHASE EQUILIBRIA

Solubility, Density, Viscosity, Refractive Index, and Electrical Conductivity for Potassium Nitrate−Water−2-Propanol at (298.15 and 313.15) K

(2009) Yi-Chen Kao et al.   JOURNAL OF CHEMICAL AND ENGINEERING DATA

Investigation of the aqueous salt solutions of some first and second group metals at various pressures

(2008) Mehmet Filiz et al.   FLUID PHASE EQUILIBRIA