Research Explorer

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Yoshi Marien

Prijzen & Erkenningen

86 Resultaten

2024

A signal‐to‐noise‐ratio‐based automated algorithm to accelerate kinetic Monte Carlo convergence in basic polymerizations

Alessandro TrigilioYoshi MarienKyann De SmitPaul Van SteenbergeDagmar D'hooge

A1 Artikel in een tijdschrift in ADVANCED THEORY AND SIMULATIONS

2023

An equation driven quality classification of (a)symmetric gradient, gradient-block, block-gradient-block and block copolymers

Robert ConkaYoshi MarienPaul Van SteenbergeRichard HoogenboomDagmar D'hooge

A1 Artikel in een tijdschrift in EUROPEAN POLYMER JOURNAL

Coupled matrix-based Monte Carlo modeling for a mechanistic understanding of poly (methyl methacrylate) thermochemical recycling kinetics

Eli MoensYoshi MarienFreddy Figueira De BarrosAlessandro TrigilioKyann De SmitKevin Van GeemPaul Van SteenbergeDagmar D'hooge

A1 Artikel in een tijdschrift in CHEMICAL ENGINEERING JOURNAL

How phase transfer increases the number of kinetic regimes from three to seven in nitroxide mediated polymerization of n-butyl acrylate in aqueous miniemulsion

Elnaz ZeinaliYoshi MarienSean R. GeorgeMichael F. CunninghamDagmar D'hoogePaul Van Steenberge

A1 Artikel in een tijdschrift in CHEMICAL ENGINEERING JOURNAL

How to automate the convergence in basic and complex kMC simulations for polymerization processes

Alessandro TrigilioYoshi MarienPaul Van SteenbergeDagmar D'hooge

Kinetic Monte Carlo convergence demands for thermochemical recycling kinetics of vinyl polymers with dominant depropagation

Eli MoensYoshi MarienAlessandro TrigilioKevin Van GeemPaul Van SteenbergeDagmar D'hooge

A1 Artikel in een tijdschrift in PROCESSES

Kinetic Monte Carlo residence time distributions and kinetics in view of extrusion-based polymer modification and recycling

Kyann De SmitMariya EdelevaAlessandro TrigilioYoshi MarienPaul Van SteenbergeDagmar D'hooge

A1 Artikel in een tijdschrift in REACTION CHEMISTRY & ENGINEERING

Molecular scale-driven upgrading of extrusion technology for sustainable polymer processing and recycling

Mariya EdelevaKyann De SmitSimon DebrieAnnabelle VerberckmoesYoshi MarienDagmar D'hooge

A1 Artikel in een tijdschrift in CURRENT OPINION IN GREEN AND SUSTAINABLE CHEMISTRY

Monte Carlo tools for next-generation polymer recycling and design

Yoshi MarienMariya EdelevaLudwig CardonPaul Van SteenbergeDagmar D'hooge

Multi-angle evaluation of kinetic Monte-Carlo simulations as a tool to evaluate the distributed monomer composition in gradient copolymer synthesis

Robert ConkaYoshi MarienPaul Van SteenbergeRichard HoogenboomDagmar D'hooge

A1 Artikel in een tijdschrift in REACTION CHEMISTRY & ENGINEERING

Multi-scale theoretical tools for in silico macromolecular chemistry and engineering

Mariya EdelevaFrancisco Jose Arraez HernandezYi-Yang WuFreddy Figueira De BarrosYoshi MarienYin-Ning ZhouZheng-Hong LuoPaul Van SteenbergeDagmar D'hooge

Hoofdstuk in een boek in In-silico approaches to macromolecular chemistry

Playing with process conditions to increase the industrial sustainability of poly(lactic acid)-based materials

Kyann De SmitYoshi MarienPaul Van SteenbergeDagmar D'hoogeMariya Edeleva

A1 Artikel in een tijdschrift in REACTION CHEMISTRY & ENGINEERING

Pushing forward coupled matrix-based Monte Carlo simulations for polymer circularity

Yoshi MarienKyann De SmitAnnabelle VerberckmoesAlessandro TrigilioMariya EdelevaPaul Van SteenbergeLudwig CardonDagmar D'hooge

Simulation time analysis of kinetic Monte Carlo algorithmic steps for basic radical (de)polymerization kinetics of linear polymers

Alessandro TrigilioYoshi MarienMariya EdelevaDagmar D'hoogePaul Van Steenberge

A1 Artikel in een tijdschrift in REACTION CHEMISTRY & ENGINEERING

The identification of seven kinetic regimes for NMP of n‑butyl acrylate in aqueous miniemulsion : the role of compartmentalization and phase transfer

Elnaz ZeinaliYoshi MarienSean R. GeorgeMichael F. CunninghamDagmar D'hoogePaul Van Steenberge

Thermochemical recycling kinetics of poly(methyl methacrylate) : from thermogravimetric to in silico degradation analysis

Eli MoensDagmar D'hoogeYoshi Marien

Toward an automated convergence tool for kinetic Monte Carlo simulation of conversion, distributions, and their averages in non-dispersed phase linear chain-growth polymerization

Alessandro TrigilioYoshi MarienPaul Van SteenbergeDagmar D'hooge

A1 Artikel in een tijdschrift in INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

2022

A unified kinetic Monte Carlo approach to evaluate (a)symmetric block and gradient copolymers with linear and branched chains illustrated for poly(2-oxazoline)s

Robert ConkaYoshi MarienOndrej SedlacekRichard HoogenboomPaul Van SteenbergeDagmar D'hooge

A1 Artikel in een tijdschrift in POLYMER CHEMISTRY

An experimental study on thermochemical degradation of acrylic polymers

Eli MoensGilles DosscheSara JanssensLander NelisWim TemmermanYoshi MarienKevin Van GeemPaul Van SteenbergeDagmar D'hooge

Connecting thermoplastic polymer synthesis with its recycling

Kyann De SmitYoshi MarienKevin Van GeemPaul Van SteenbergeDagmar D'hooge

Design of lab-scale depolymerization experiments

Eli MoensYoshi Marien

Hoofdstuk in een boek in Polymer circularity roadmap : recycling of poly(methyl methacrylate) as a case study

Differences and similarities between mono-, bi- or tetrafunctional initiated cationic ring-opening polymerization of 2-oxazolines

Francisco Jose Arraez HernandezXiaowen XuMariya EdelevaPaul Van SteenbergeYoshi MarienValentin-Victor JercaRichard HoogenboomDagmar D'hooge

Differences and similarities between mono-, bi- or tetrafunctional initiated cationic ring-opening polymerization of 2-oxazolines

Francisco Jose Arraez HernandezXiaowen XuMariya EdelevaPaul Van SteenbergeYoshi MarienValentin-Victor JercaRichard HoogenboomDagmar D'hooge

A1 Artikel in een tijdschrift in POLYMER CHEMISTRY

How far can we push nitroxide mediated polymerization for precision synthesis of polymer colloids?

Yoshi MarienElnaz ZeinaliSean R. GeorgesPer B. ZetterlundMichael F. CunninghamPaul Van SteenbergeDagmar D'hooge

How increasingly powerful PRE modeling tools allow to unlock the full potential of FRP and RDRP in aqueous emulsion

Yoshi MarienElnaz ZeinaliSean R. GeorgesPer B. ZetterlundMichael F. CunninghamPaul Van SteenbergeDagmar D'hooge

Identifying optimal synthesis protocols via the in silico characterization of (a)symmetric block and gradient copolymers with linear and branched chains

Robert ConkaYoshi MarienOndrej SedlacekPaul Van SteenbergeRichard HoogenboomDagmar D'hooge

Increasing the kMC potential from linear to branched polymers : the case of surface-initiated polymerization and its 3D representation

Alessandro TrigilioFrancisco Jose Arraez HernandezMariya EdelevaYoshi MarienPaul Van SteenbergeDagmar D'hooge

Model-based kinetic design of poly(methyl methacrylate) chemical recycling

Eli MoensYoshi MarienKyann De SmitKevin Van GeemPaul Van SteenbergeDagmar D'hooge

Model-guided study of 2-oxazolines cationic ring-opening polymerization with special attention to side reactions

Mariya EdelevaFrancisco Jose Arraez HernandezPaul Van SteenbergeXiaowen XuValentin-Victor JercaYoshi MarienRichard HoogenboomDagmar D'hooge

Molecularly imprinted polymers with enhanced selectivity based on 4-(aminomethyl)pyridine-functionalized poly(2-oxazoline)s for detecting hazardous herbicide contaminants

Michal CeglowskiYoshi MarienSander SmeetsLieselot De SmetDagmar D'hoogeGrzegorz SchroederRichard Hoogenboom

A1 Artikel in een tijdschrift in CHEMISTRY OF MATERIALS

Multi-scale reactive extrusion modelling approaches to design polymer synthesis, modification and mechanical recycling

Kyann De SmitTom WiemeYoshi MarienPaul Van SteenbergeDagmar D'hoogeMariya Edeleva

A1 Artikel in een tijdschrift in REACTION CHEMISTRY & ENGINEERING

Optimal search methods for selecting distributed species in Gillespie-based kinetic Monte Carlo

Alessandro TrigilioYoshi MarienMariya EdelevaPaul Van SteenbergeDagmar D'hooge

A1 Artikel in een tijdschrift in COMPUTERS & CHEMICAL ENGINEERING

Performance analysis of kinetic Monte Carlo algorithms for synthesis of linear polymers

Alessandro TrigilioYoshi MarienMariya EdelevaPaul Van SteenbergeDagmar D'hooge

Polymer circularity roadmap : recycling of poly(methyl methacrylate) as a case study

Dagmar D'hoogeYoshi MarienJean-Luc Dubois

Purification of regenerated monomers

Fady BoutrosMichiel Van MelkebekeClément LemenuPhilippe De Groote

Hoofdstuk in een boek in Polymer circularity roadmap : recycling of poly(methyl methacrylate) as a case study

Pushing forward the predictive power of kinetic Monte Carlo simulations for detailed (de)polymerization chemistries

Yoshi MarienAlessandro TrigilioMariya EdelevaPaul Van SteenbergeDagmar D'hooge

Reactions and kinetic principles behind thermochemical recycling

Hoofdstuk in een boek in Polymer circularity roadmap : recycling of poly(methyl methacrylate) as a case study

Structural composition distributions of ideal monodisperse copolymers

Robert ConkaYoshi MarienPaul Van SteenbergeRichard HoogenboomDagmar D'hooge

The impact of the residence time distribution on chemical modifications in extruders

Kyann De SmitAlessandro TrigilioMariya EdelevaYoshi MarienPaul Van SteenbergeDagmar D'hooge

Thermal and thermal-oxidative molecular degradation of polystyrene and acrylonitrile butadiene styrene during 3D printing starting from filaments and pellets

Daniel Victor Amaral CerettiYoshi MarienMariya EdelevaAndrea La GalaLudwig CardonDagmar D'hooge

A1 Artikel in een tijdschrift in SUSTAINABILITY

Tracking four radical types in miniemulsion NMP of acrylates to unravel seven kinetic regimes

Elnaz ZeinaliYoshi MarienSean R. GeorgeMichael F. CunninghamDagmar D'hoogePaul Van Steenberge

Why perfectly controlled gradient copolymers don’t exist

Robert ConkaYoshi MarienOndrej SedlacekRichard HoogenboomPaul Van SteenbergeDagmar D'hooge

2021

A unified approach to evaluate (a)symmetric block and gradient (branched) polymer structures

Robert ConkaYoshi MarienPaul Van SteenbergeRichard HoogenboomDagmar D'hooge

Detailed study of the kinetic features of miniemulsion NMP of n-Butyl acrylate

Elnaz ZeinaliYoshi MarienSean GeorgeMichael CunninghamDagmar D'hoogePaul Van Steenberge

Driving circularity of vinyl polymers via a unified stochastic modeling framework for polymer synthesis and subsequent degradation

Yoshi MarienKyann De SmitEli MoensPaul Van SteenbergeKevin Van GeemDagmar D'hooge

Evaluating the effect of compartmentalization and partitioning on the miniemulsion NMP kinetics of n-butyl acrylate through a 4D-population balance model

Elnaz ZeinaliYoshi MarienSean GeorgeMichael CunninghamDagmar D'hoogePaul Van Steenberge

Exploiting (multicomponent) semibatch and jacket temperature procedures to safely tune molecular properties for solution free radical polymerization of n‐butyl acrylate

Mariya EdelevaYoshi MarienDagmar D'hoogePaul Van Steenberge

A1 Artikel in een tijdschrift in MACROMOLECULAR THEORY AND SIMULATIONS

Green degradable (co)polyacrylics : a kinetic Monte Carlo study

Kyann De SmitYoshi MarienKevin Van GeemPaul Van SteenbergeDagmar D'hooge

Guidelines on translating chain length and molar mass distributions in polymer science

Yoshi MarienMariya EdelevaFreddy Figueira De BarrosFrancisco Jose Arraez HernandezPaul Van SteenbergeDagmar D'hooge

How pulsed laser polymerization can help to understand radical polymerization kinetics

Yoshi MarienMariya EdelevaAnil VirC. Barner-KowollikPaul Van SteenbergeDagmar D'hooge

Impact of side reactions on molar mass distribution, unsaturation level and branching density in solution free radical polymerization of n-butyl acrylate under well-defined lab-scale reactor conditions

Mariya EdelevaYoshi MarienPaul Van SteenbergeDagmar D'hooge

A1 Artikel in een tijdschrift in POLYMER CHEMISTRY

Jacket temperature regulation allowing well-defined non-adiabatic lab-scale solution free radical polymerization of acrylates

Mariya EdelevaYoshi MarienPaul Van SteenbergeDagmar D'hooge

A1 Artikel in een tijdschrift in REACTION CHEMISTRY & ENGINEERING

Kinetic Monte Carlo modeling to extract mechanistic and kinetic information from chain length and particle size distributions in radical polymerization

Yoshi MarienMariya EdelevaPaul Van SteenbergeDagmar D'hooge

Prediction of partitioning and compartmentalization effects in SG1-mediated miniemulsion polymerization of n-butyl acrylate

Elnaz ZeinaliYoshi MarienSean GeorgeMichael CunninghamDagmar D'hoogePaul Van Steenberge

Translating simulated chain length and molar mass distributions in chain‐growth polymerization for experimental comparison and mechanistic insight

Yoshi MarienMariya EdelevaFreddy Figueira De BarrosFrancisco Jose Arraez HernandezPaul Van SteenbergeDagmar D'hooge

A1 Artikel in een tijdschrift in MACROMOLECULAR THEORY AND SIMULATIONS

Translating simulated chain length and molar mass distributions in chain‐growth polymerization for experimental comparison and mechanistic insight

Yoshi MarienMariya EdelevaFreddy Figueira De BarrosFrancisco Jose Arraez HernandezPaul Van SteenbergeDagmar D'hooge

2020

Benchmarking stochastic and deterministic kinetic modeling of bulk and solution radical polymerization processes by including six types of factors two

Lies De KeerFreddy Figueira De BarrosYoshi MarienKyann De SmitMariya EdelevaPaul Van SteenbergeDagmar D'hooge

A1 Artikel in een tijdschrift in MACROMOLECULAR THEORY AND SIMULATIONS

Connecting polymer synthesis and chemical recycling on a chain-by-chain basis : a unified matrix-based kinetic Monte Carlo strategy

Kyann De SmitYoshi MarienKevin Van GeemPaul Van SteenbergeDagmar D'hooge

Connecting polymer synthesis and chemical recycling on a chain-by-chain basis : a unified matrix-based kinetic Monte Carlo strategy

Kyann De SmitYoshi MarienKevin Van GeemPaul Van SteenbergeDagmar D'hooge

A1 Artikel in een tijdschrift in REACTION CHEMISTRY & ENGINEERING

Exploiting the pulsed laser polymerization-size exclusion chromatography technique to retrieve kinetic parameters in radical polymerization: State-ofthe- art and future challenges

Yoshi MarienMariya EdelevaPaul Van SteenbergeDagmar D'hooge

Hoofdstuk in een boek in Advances in polymer reaction engineering

Gillespie-driven kinetic Monte Carlo algorithms to model events for bulk and solution (bio)chemical systems containing elemental and distributed species

Alessandro TrigilioYoshi MarienPaul Van SteenbergeDagmar D'hooge

A1 Artikel in een tijdschrift in INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Playing with and coupling kinetic Monte Carlo matrices to map polymer reaction engineering applications

Paul Van SteenbergeFreddy Figueira De BarrosLies De KeerMariya EdelevaAlessandro TrigilioYoshi MarienDagmar D'hooge

Progress in reaction mechanisms and reactor technologies for thermochemical recycling of poly(methyl methacrylate)

Eli MoensKyann De SmitYoshi MarienAlessandro TrigilioPaul Van SteenbergeKevin Van GeemJean-Luc DuboisDagmar D'hooge

A1 Artikel in een tijdschrift in POLYMERS

Roadmap for monomer conversion and chain length-dependent termination reactivity algorithms in kinetic Monte Carlo modeling of bulk radical polymerization

Kyann De SmitYoshi MarienMariya EdelevaPaul Van SteenbergeDagmar D'hooge

A1 Artikel in een tijdschrift in INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

2019

A detailed understanding of RAFT bulk and miniemulsion polymerization

Dries DevlaminckYoshi MarienFrancisco Jose Arraez HernandezMarie-Françoise ReyniersPaul Van SteenbergeDagmar D'hooge

Arrhenius parameters for acrylate radical polymerization using low and high temperature pulsed laser polymerization data

Yoshi MarienAnil VirPaul Van SteenbergeFrancisco Jose Arraez HernandezChristopher Barner-KowollikMarie-Françoise ReyniersGuy MarinDagmar D'hooge

Coupled stochastic simulation of the chain length and particle size distribution in miniemulsion radical copolymerization of styrene and N-vinylcaprolactam

Yoshi MarienPaul Van SteenbergeAndrij PichDagmar D'hooge

A1 Artikel in een tijdschrift in REACTION CHEMISTRY & ENGINEERING

Coupled stochastic simulation of the chain length and particle size distribution in miniemulsion radical copolymerization of styrene and N-vinylcaprolactam

Yoshi MarienPaul Van SteenbergeAndrij PichDagmar D'hooge

Deterministic modelling of RAFT bulk and mini-emulsion polymerization up to high monomer conversion

Dries DevlaminckYoshi MarienLies De KeerMarie-Françoise ReyniersPaul Van SteenbergeDagmar D'hooge

From n-butyl acrylate Arrhenius parameters for backbiting and tertiary propagation to β-scission via stepwise pulsed laser polymerization

Anil VirYoshi MarienPaul Van SteenbergeChristopher Barner-KowollikMarie-Françoise ReyniersGuy MarinDagmar D'hooge

A1 Artikel in een tijdschrift in POLYMER CHEMISTRY

From n-butyl acrylate Arrhenius parameters for backbiting and tertiary propagation to β-scission via stepwise pulsed laser polymerization

Anil VirYoshi MarienPaul Van SteenbergeChristopher Barner-KowollikMarie-Françoise ReyniersGuy MarinDagmar D'hooge

Kinetic Monte Carlo modeling of multimodal distributions in pulsed laser and miniemulsion polymerization

Yoshi MarienDagmar D'hoogeGuy Marin

Particle by particle kinetic Monte Carlo tracking of reaction and mass transfer events in miniemulsion free radical polymerization

Yoshi MarienPaul Van SteenbergeDagmar D'hoogeGuy Marin

A1 Artikel in een tijdschrift in MACROMOLECULES

Pulsed laser polymerization of acrylates : access to tertiary propagation, backbiting and beta-scission Arrhenius parameters

Yoshi MarienAnil VirPaul Van SteenbergeFrancisco Jose Arraez HernandezChristopher Barner-KowollikMarie-Françoise ReyniersGuy MarinDagmar D'hooge

The interaction between the chain length and particle size distribution in radical miniemulsion (co)polymerization : going beyond the Smith-Ewart approach

Yoshi MarienPaul Van SteenbergeAndrij PichDagmar D'hooge

2018

A Novel Interpretation of Measured and Simulated PLP Data

Yoshi MarienPaul Van SteenbergeGilles DesmetChristopher Barner-KowollikMarie-Françoise ReyniersGuy MarinDagmar D'hooge

Access to the β-scission rate coefficient in acrylate radical polymerization by careful scanning of pulse laser frequencies at elevated temperature

Anil VirYoshi MarienPaul Van SteenbergeChristopher Barner-KowollikMarie-Françoise ReyniersGuy MarinDagmar D'hooge

A1 Artikel in een tijdschrift in REACTION CHEMISTRY & ENGINEERING

Exploring pulsed laser polymerization in view of reactor design and control

Yoshi MarienPaul Van SteenbergeAnil VirC. Barner-KowollikMarie-Françoise ReyniersGuy MarinDagmar D'hooge

Pulsed laser (co)polymerization to determine intrinsic rate coefficients

Yoshi MarienPaul Van SteenbergeAnil VirC. Barner-KowollikMarie-Françoise ReyniersGuy MarinDagmar D'hooge

2017

Ab initio based kinetic Monte Carlo analysis to unravel the propagation kinetics in vinyl acetate pulsed laser polymerization

Gilles DesmetYoshi MarienPaul Van SteenbergeDagmar D'hoogeMarie-Françoise ReyniersGuy Marin

A1 Artikel in een tijdschrift in POLYMER CHEMISTRY

Estimating the photodissociation quantum yield from PLP-SEC peak heights

Yoshi MarienPaul Van SteenbergeKatrin KocklerChristopher Barner-KowollikMarie-Françoise ReyniersGuy MarinDagmar D'hooge

A1 Artikel in een tijdschrift in POLYMER CHEMISTRY

Kinetic Monte Carlo modeling extracts information on chain initiation and termination from complete PLP-SEC traces

Yoshi MarienPaul Van SteenbergeChristopher Barner-KowollikMarie-Françoise ReyniersGuy MarinDagmar D'hooge

A1 Artikel in een tijdschrift in MACROMOLECULES

Pulsed Laser Polymerization Revisited : From the Photodissociation Quantum Yield to the Chain Initiation, Propagation, Backbiting and Termination Reactivity

Yoshi MarienPaul Van SteenbergeKatrin KocklerChristopher Barner-KowollikMarie-Françoise ReyniersGuy MarinDagmar D'hooge

2016

A full exploitation of the pulsed laser polymerization technique to assess all important rate coefficients in acrylate radical polymerization

Yoshi MarienPaul Van SteenbergeKB KocklerC Barner-KowollikMarie-Françoise ReyniersDagmar D'hoogeGuy Marin

A new method for the measurement of the backbiting rate coefficient in acrylate radical polymerization

Yoshi MarienPaul Van SteenbergeKatrin KocklerCristopher Barner-KowollikMarie-Françoise ReyniersDagmar D'hoogeGuy Marin

An alternative method to estimate the bulk backbiting rate coefficient in acrylate radical polymerization

Yoshi MarienPaul Van SteenbergeKatrin B KocklerChristopher Barner-KowollikMarie-Françoise ReyniersDagmar D'hoogeGuy Marin

A1 Artikel in een tijdschrift in POLYMER CHEMISTRY