Analytical and advanced kinetic models for characterization of chain-growth copolymerization: the state-of-the-art

How chain length dependencies interfere with the bulk RAFT polymerization rate and microstructural control

(2018) Nils De Rybel et al.   CHEMICAL ENGINEERING SCIENCE

Visualization of Bivariate Sequence Length-Chain Length Distribution in Free Radical Copolymerization

(2017) Mohammad Reza Saeb et al.   MACROMOLECULAR THEORY AND SIMULATIONS

AMPS/AAm/AAc Terpolymerization: Experimental Verification of the EVM Framework for Ternary Reactivity Ratio Estimation

(2017) Alison Scott et al.   Processes

A complete understanding of the reaction kinetics for the industrial production process of expandable polystyrene

(2016) Lies De Keer et al.   AICHE JOURNAL

Mathematical modeling of the full molecular weight distribution in ATRP techniques

(2016) Iván Zapata-González et al.   AICHE JOURNAL

Modeling of RAFT Polymerization Processes Using an Efficient Monte Carlo Algorithm in Julia

(2016) Esteban Pintos et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

State-of-the-Art and Progress in Method of Moments for the Model-Based Reversible-Deactivation Radical Polymerization

(2016) Yin-Ning Zhou et al.   Macromolecular Reaction Engineering

Model-Based Design To Push the Boundaries of Sequence Control

(2016) Stijn K. Fierens et al.   MACROMOLECULES

The Combined Influence of Monomer Concentration and Ionization on Acrylamide/Acrylic Acid Composition in Aqueous Solution Radical Batch Copolymerization

(2016) Calista Preusser et al.   MACROMOLECULES

The strength of multi-scale modeling to unveil the complexity of radical polymerization

(2016) Dagmar R. D’hooge et al.   PROGRESS IN POLYMER SCIENCE

Progress in reactor engineering of controlled radical polymerization: a comprehensive review

(2016) Xiaohui Li et al.   Reaction Chemistry & Engineering

MAMA-SG1 initiated nitroxide mediated polymerization of styrene: From Arrhenius parameters to model-based design

(2015) Stijn K. Fierens et al.   CHEMICAL ENGINEERING JOURNAL

When Polymer Reaction Engineers Play Dice: Applications of Monte Carlo Models in PRE

(2015) Amanda L. T. Brandão et al.   Macromolecular Reaction Engineering

Stochastic Modeling of Polymer Microstructure From Residence Time Distribution

(2015) Tiago Lemos et al.   Macromolecular Reaction Engineering

Model-Based Visualization and Understanding of Monomer Sequence Formation in Gradient Copoly(2-oxazoline)s On the basis of 2-Methyl-2-oxazoline and 2-Phenyl-2-oxazoline

(2015) Paul H. M. Van Steenberge et al.   MACROMOLECULES

Model-based design of the polymer microstructure: bridging the gap between polymer chemistry and engineering

(2015) Dagmar R. D'hooge et al.   Polymer Chemistry

Modeling and theoretical development in controlled radical polymerization

(2015) Erlita Mastan et al.   PROGRESS IN POLYMER SCIENCE

Improved kinetic Monte Carlo simulation of chemical composition-chain length distributions in polymerization processes

(2014) P.H.M. Van Steenberge et al.   CHEMICAL ENGINEERING SCIENCE

Deterministic Modeling of Copolymer Microstructure: Composition Drift and Sequence Patterns

(2014) Ivan Kryven et al.   Macromolecular Reaction Engineering

Copolymer Composition Deviations from Mayo-Lewis Conventional Free Radical Behavior in Nitroxide Mediated Copolymerization

(2014) Iván Zapata-González et al.   MACROMOLECULAR THEORY AND SIMULATIONS

Modeling of Network Formation in Reversible Addition-Fragmentation Transfer (RAFT) Copolymerization of Vinyl/Divinyl Monomers Using a Multifunctional Polymer Molecule Approach

(2014) Julio César Hernández-Ortiz et al.   MACROMOLECULAR THEORY AND SIMULATIONS

A Detailed Model on Kinetics and Microstructure Evolution during Copolymerization of Ethylene and 1-Octene: From Coordinative Chain Transfer to Chain Shuttling Polymerization

(2014) Yousef Mohammadi et al.   MACROMOLECULES

Solvent Effects on Kinetics of 2-Hydroxyethyl Methacrylate Semibatch Radical Copolymerization

(2013) Kun Liang et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

First principles modelling of free-radical polymerisation kinetics

(2013) Benjamin B. Noble et al.   INTERNATIONAL REVIEWS IN PHYSICAL CHEMISTRY

Software for Demonstration of Features of Chain Polymerization Processes

(2013) Stanislaw Sosnowski   JOURNAL OF CHEMICAL EDUCATION

The Crucial Role of Diffusional Limitations in Controlled Radical Polymerization

(2013) Dagmar R. D'hooge et al.   Macromolecular Reaction Engineering

A Theoretical Exploration of the Potential of ICAR ATRP for One- and Two-Pot Synthesis of Well-Defined Diblock Copolymers

(2013) Carolina Toloza Porras et al.   Macromolecular Reaction Engineering

The Use of Instantaneous Distributions in Polymerization Reaction Engineering

(2013) João B. P. Soares   Macromolecular Reaction Engineering

Modeling of Functional Group Distribution in Copolymerization: A Comparison of Deterministic and Stochastic Approaches

(2013) M. Ali Parsa et al.   MACROMOLECULAR THEORY AND SIMULATIONS

Comparative Kinetic Monte Carlo study of the Sulfinyl and Dithiocarbamate Precursor Route toward Highly Regioregular MDMO-PPV

(2013) Paul H. M. Van Steenberge et al.   MACROMOLECULAR THEORY AND SIMULATIONS

ARGET ATRP of Butyl Methacrylate: Utilizing Kinetic Modeling To Understand Experimental Trends

(2013) Kevin A. Payne et al.   MACROMOLECULES

Controlled synthesis of poly[(butyl methacrylate)-co-(butyl acrylate)] via activator regenerated by electron transfer atom transfer radical polymerization: insights and improvement

(2013) Kevin A Payne et al.   POLYMER INTERNATIONAL

Efficient numerical integration of stiff differential equations in polymerisation reaction engineering: Computational aspects and applications

(2012) Iván Zapata-González et al.   CANADIAN JOURNAL OF CHEMICAL ENGINEERING

Multidimensional high-temperature liquid chromatography: A new technique to characterize the chemical heterogeneity of Ziegler-Natta-based bimodal HDPE

(2012) Anton Ginzburg et al.   JOURNAL OF APPLIED POLYMER SCIENCE

Copolymer Composition Determined by LC-MALDI-TOF MS Coupling and “MassChrom2D” Data Analysis

(2012) Steffen M. Weidner et al.   MACROMOLECULAR CHEMISTRY AND PHYSICS

A QM Approach to the Calculation of Reactivity Ratios in Free-Radical Copolymerization

(2012) Marco Dossi et al.   Macromolecular Reaction Engineering

Linear Gradient Quality of ATRP Copolymers

(2012) Paul H. M. Van Steenberge et al.   MACROMOLECULES

Reactivity Ratios of Comonomers from a Single MALDI–ToF–MS Measurement at One Feed Composition

(2012) Saskia Huijser et al.   MACROMOLECULES

Bimodality Criterion for the Chemical Composition Distribution of Ethylene/1-Olefin Copolymers: Theoretical Development and Experimental Validation

(2011) Kanyanut Narkchamnan et al.   Macromolecular Reaction Engineering

Returning to Basics: Direct Integration of the Full Molecular-Weight Distribution Equations in Addition Polymerization

(2010) Enrique Saldívar-Guerra et al.   MACROMOLECULAR THEORY AND SIMULATIONS

Tracking Explicit Chain Sequence in Kinetic Monte Carlo Simulations

(2010) Lin Wang et al.   MACROMOLECULAR THEORY AND SIMULATIONS

Tuning Block Compositions of Polyethylene Multi-Block Copolymers by Catalyst Selection

(2010) Roger L. Kuhlman et al.   MACROMOLECULES

A Novel Stochastic Approach for the Prediction of the Exact Topological Characteristics and Rheological Properties of Highly-Branched Polymer Chains

(2010) Dimitrios Meimaroglou et al.   MACROMOLECULES

Kinetics of Segment Formation in Nitroxide-Mediated Controlled Radical Polymerization: Comparison with Classic Theory

(2010) Lin Wang et al.   MACROMOLECULES

Stochastic modelling of gradient copolymer chemical composition distribution and sequence length distribution

(2010) Andrew S. Cho et al.   MOLECULAR SIMULATION

Mechanistic considerations on styrene–maleic anhydride copolymerization reactions

(2010) Bert Klumperman   Polymer Chemistry

Chain Transfer to Polymer and Branching in Controlled Radical Polymerizations ofn-Butyl Acrylate

(2009) Nasir M. Ahmad et al.   MACROMOLECULAR RAPID COMMUNICATIONS

Methodology for Kinetic Modeling of Atom Transfer Radical Polymerization

(2009) Dagmar R. D'hooge et al.   Macromolecular Reaction Engineering

Factors Affecting the Formation of the Monomer Sequence along Styrene/Methyl Methacrylate Gradient Copolymer Chains

(2009) Lin Wang et al.   MACROMOLECULES

Chain-length-dependent termination in radical polymerization: Subtle revolution in tackling a long-standing challenge

(2009) Christopher Barner-Kowollik et al.   PROGRESS IN POLYMER SCIENCE

Dynamic prediction of the bivariate molecular weight–copolymer composition distribution using sectional-grid and stochastic numerical methods

(2008) Apostolos Krallis et al.   CHEMICAL ENGINEERING SCIENCE

Bimolecular radical termination: New perspectives and insights

(2008) Geoffrey Johnston-Hall et al.   JOURNAL OF POLYMER SCIENCE PART A-POLYMER CHEMISTRY

Computer Aided Modeling of Polymer Reaction Engineering-The Status of Predici, I-Simulation

(2008) Michael Wulkow   Macromolecular Reaction Engineering

The Effect of Activation/Deactivation Processes on the Microcomposition and Microsequence Structure of Controlled/Living Copolymers

(2008) Ying Shi et al.   MACROMOLECULAR THEORY AND SIMULATIONS

Effect of the Penultimate Unit on the CON Bond Homolysis in SG1-Based Alkoxyamines

(2007) Denis Bertin et al.   MACROMOLECULAR CHEMISTRY AND PHYSICS