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Direct aminolysis of methyl esters with ammonia in continuous flow through Bayesian optimization
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Electrochemical hydrocarboxylation of styrene with CO2 in continuous flow
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Comparing SG1 and TEMPO for NMP of n-butyl acrylate in miniemulsion to optimize the average particle size for rate and molecular control
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Oxidative cleavage of lignin model substrates with Co(salen) catalyst : an experimental study on the effect of different reaction parameters in batch and continuous flow
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Merging inline crystallization and pulsed flow operation to enable enantiospecific solid state photodecarbonylation
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Development of a solid-compatible continuous flow reactor for the paraformaldehyde slurry mediated 𝛼-hydroxymethylation of methyl vinyl ketone
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Multi-angle evaluation of kinetic Monte-Carlo simulations as a tool to evaluate the distributed monomer composition in gradient copolymer synthesis
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Kinetic Monte Carlo residence time distributions and kinetics in view of extrusion-based polymer modification and recycling
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Simulation time analysis of kinetic Monte Carlo algorithmic steps for basic radical (de)polymerization kinetics of linear polymers
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A stepwise kinetic approach to quantify rate coefficients for reactant-, auto- and non-catalyzed urethanization of phenyl isocyanate and 1-butanol
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A stepwise kinetic approach to quantify rate coefficients for reactant-, auto- and non-catalyzed urethanization of phenyl isocyanate and 1-butanol
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- Journal Article
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Playing with process conditions to increase the industrial sustainability of poly(lactic acid)-based materials
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Plasma nitrogen fixation in the presence of a liquid interface : role of OH radicals
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Multi-scale reactive extrusion modelling approaches to design polymer synthesis, modification and mechanical recycling
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Unravelling the redox mechanism and kinetics of a highly active and selective Ni-based material for the oxidative dehydrogenation of ethane
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Coupled matrix kinetic Monte Carlo simulations applied for advanced understanding of polymer grafting kinetics
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Jacket temperature regulation allowing well-defined non-adiabatic lab-scale solution free radical polymerization of acrylates
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- Journal Article
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Extracting kinetic information in catalysis : an automated tool for the exploration of small data
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Coupled matrix kinetic Monte Carlo simulations applied for advanced understanding of polymer grafting kinetics
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Machine learning based interpretation of microkinetic data : a Fischer-Tropsch synthesis case study
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Connecting polymer synthesis and chemical recycling on a chain-by-chain basis : a unified matrix-based kinetic Monte Carlo strategy
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Sustainable innovations in steam cracking : CO2 neutral olefin production
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- Journal Article
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Catalyst screening for the oxidative coupling of methane : from isothermal to adiabatic operation via microkinetic simulations
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Towards high-performance heterogeneous palladium nanoparticle catalysts for sustainable liquid-phase reactions
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- Journal Article
- A1
- open access
Connecting polymer synthesis and chemical recycling on a chain-by-chain basis : a unified matrix-based kinetic Monte Carlo strategy
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The behavior and modelling of the vibrational-to-translational temperature ratio at long time scales in CO2 vibrational kinetics
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A two-step modelling approach for plasma reactors : experimental validation for CO2 dissociation in surface wave microwave plasma
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- Journal Article
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Coupled stochastic simulation of the chain length and particle size distribution in miniemulsion radical copolymerization of styrene and N-vinylcaprolactam
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- Journal Article
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Kinetic evaluation of chitosan-derived catalysts for the aldol reaction in water
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Coupled stochastic simulation of the chain length and particle size distribution in miniemulsion radical copolymerization of styrene and N-vinylcaprolactam
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Access to the β-scission rate coefficient in acrylate radical polymerization by careful scanning of pulse laser frequencies at elevated temperature
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Two-compartment kinetic Monte Carlo modelling of electrochemically mediated ATRP
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Analytical and advanced kinetic models for characterization of chain-growth copolymerization : the state-of-the-art
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A new methodology for the reduction of vibrational kinetics in non-equilibrium microwave plasma : application to CO2 dissociation