Department of Chemical Engineering and Chemistry

Research Output 1939 2020

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Article
2020

An improved subgrid scale model for front‐tracking based simulations of mass transfer from bubbles

Claassen, C. M. Y., Islam, M. S., Peters, E. A. J. F. F., Deen, N. G., Kuipers, J. A. M. H. & Baltussen, M. W., 2020, (Accepted/In press) In : AIChE Journal. e16889.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
Bubbles (in fluids)
Industry
Mass transfer
Boundary layers
Bubble columns
1 Citation (Scopus)
6 Downloads (Pure)

A quantum-chemical study of the CO dissociation mechanism on low-index Miller planes of ϴ-Fe 3 C

Broos, R. J. P., Klumpers, B., Zijlstra, B., Filot, I. A. W. & Hensen, E. J. M., 15 Feb 2020, In : Catalysis Today. 342, p. 152-160 9 p.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Carbon Monoxide
Chemical activation
Carbides
Fischer-Tropsch synthesis
Cobalt
1 Downloads (Pure)

Architecture-dependent interplay between self-assembly and crystallization in discrete block co-oligomers

Petkau-Milroy, K., Ianiro, A., Ahn, M. M. L., Magana, J. R., Vleugels, M. E. J., Lamers, B. A. G., Tuinier, R., Voets, I. K., Palmans, A. R. A. & Meijer, E. W., 2020, In : ACS Macro Letters. 9, p. 38-42 5 p.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Crystallization
Oligomers
Self assembly
Water
Lactic acid

Aromatization of ethylene over zeolite-based catalysts

Uslamin, E. A., Saito, H., Kosinov, N. A., Pidko, E. A., Sekine, Y. & Hensen, E. J. M., 2020, (Accepted/In press) In : Catalysis Science & Technology.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
Aromatization
Zeolites
Ethylene
Catalysts
Aromatic compounds
2 Downloads (Pure)

A soft transporter robot fueled by light

Da Cunha, M. P., Ambergen, S., Debije, M. G., Homburg, F. G. A. E., den Toonder, J. M. J. & Schenning, A. P. H. J., 2020, In : Advanced Science.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
transporter
robots
locomotion
Locomotion
Robots

CFD analysis of a luminescent solar concentrator-based photomicroreactor (LSC-PM) with feedforward control applied to the synthesis of chemicals under fluctuating light intensity

de Oliveira, G. X., Lira, J. O. B., Cambié, D., Noël, T., Riella, H. G., Padoin, N. & Soares, C., 1 Jan 2020, In : Chemical Engineering Research and Design. 153, p. 626-634 9 p.

Research output: Contribution to journalArticleAcademicpeer-review

Solar concentrators
Feedforward control
Dynamic analysis
Computational fluid dynamics
Dynamic models
2 Citations (Scopus)
5 Downloads (Pure)

Combined light and electric response of topographic liquid crystal network surfaces

Feng, W., Broer, D. J. & Liu, D., 10 Jan 2020, In : Advanced Functional Materials. 30, 2, 7 p., 1901681.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Liquid Crystals
Liquid crystals
liquid crystals
elimination
actuators
6 Downloads (Pure)

Controlling the microstructure of conjugated polymers in high-mobility monolayer transistors via the dissolution temperature

Li, M., Bin, H., Jiao, X., Wienk, M. M., Yan, H. & Janssen, R. A. J., 7 Jan 2020, In : Angewandte Chemie - International Edition. 59, 2, p. 846-852 7 p.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Conjugated polymers
Monolayers
Transistors
Dissolution
Polymers
9 Downloads (Pure)

Direct numerical simulation of a non-isothermal non-adiabatic packed bed reactor

Chandra, V., Peters, E. A. J. F. & Kuipers, J. A. M., 1 Apr 2020, In : Chemical Engineering Journal. 385, 16 p., 123641.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Direct numerical simulation
Packed beds
simulation
discrete element method
mass transport
1 Downloads (Pure)

Distinct pathways in "thermally bisignate supramolecular polymerization": spectroscopic and computational studies

Rao, K. V., Mabesoone, M. F. J., Miyajima, D., Nihonyanagi, A., Meijer, E. W. & Aida, T., 8 Jan 2020, In : Journal of the American Chemical Society. 142, 1, p. 598-605 8 p.

Research output: Contribution to journalArticleAcademicpeer-review

Polymerization
Monomers
Heating
Polymers
Porphyrins

Ditopic binuclear copper(II) complexes for DNA cleavage

Carreira-Barral, I., Riopedre-Fernández, M., de Blas, A., Mosquera, J., Vázquez, M. E., Platas-Iglesias, C. & Esteban-Gómez, D., Apr 2020, In : Journal of Inorganic Biochemistry. 205, 110995.

Research output: Contribution to journalArticleAcademicpeer-review

DNA Cleavage
Copper
DNA
Ligands
Methyl Green
1 Downloads (Pure)

Dual light and temperature responsive micrometer-sized structural color actuators

Belmonte, A., Ussembayev, Y. Y., Bus, T., Nys, I., Neyts, K. & Schenning, A. P. H. J., 9 Jan 2020, In : Small. 16, 1, 1905219.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Actuators
Color
Light
Temperature
Liquid Crystals
6 Downloads (Pure)

Effect of proximity and support material on deactivation of bifunctional catalysts for the conversion of synthesis gas to olefins and aromatics

Weber, J. L., Krans, N. A., Hofmann, J. P., Hensen, E. J. M., Zecevic, J., de Jongh, P. E. & de Jong, K. P., 15 Feb 2020, In : Catalysis Today. 342, p. 161-166 6 p.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Synthesis gas
Alkenes
Catalyst supports
Olefins
Catalysts

Electrochemical stability of RuO2(110)/Ru(0001) model electrodes in the oxygen and chlorine evolution reactions

Goryachev, A., Etzi Coller Pascuzzi, M., Carlà, F., Weber, T., Over, H., Hensen, E. J. M. & Hofmann, J. P., 2020, (Accepted/In press) In : Electrochimica Acta. 336, 135713.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
4 Downloads (Pure)

Epitaxial growth of light-responsive azobenzene molecular crystal actuators on oriented polyethylene films

Varghese, S., Fredrich, S., Vantomme, G., Prabhu, S. R., Teyssandier, J., de Feyter, S., Severn, J., Bastiaansen, C. W. M. & Schenning, A. P. H. J., 2020, In : Journal of Materials Chemistry C. 8, 2, p. 694-699 6 p.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Molecular crystals
Azobenzene
Polyethylene
Epitaxial growth
Polyethylenes
4 Downloads (Pure)

Experimental evidence for algebraic double-layer forces

Stojimirović, B., Vis, M., Tuinier, R., Philipse, A. P. & Trefalt, G., Jan 2020, In : Langmuir. 36, p. 47-54 8 p.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
decay
interactions
profiles
1 Citation (Scopus)
3 Downloads (Pure)

First-principles based microkinetic modeling of transient kinetics of CO hydrogenation on cobalt catalysts

Zijlstra, B., Broos, R., Chen, W., Filot, I. & Hensen, E., 15 Feb 2020, In : Catalysis Today. 342, p. 131-141 11 p.

Research output: Contribution to journalArticleAcademicpeer-review

Carbon Monoxide
Cobalt
Hydrogenation
Catalysts
Kinetics

First-principles microkinetics simulations of electrochemical reduction of CO2 over Cu catalysts

Zijlstra, B., Zhang, X., Liu, J-X., Filot, I. A. W., Zhou, Z., Sun, S. & Hensen, E. J. M., 2020, (Accepted/In press) In : Electrochimica Acta.

Research output: Contribution to journalArticleAcademicpeer-review

Flow induced by an oscillating sphere in probing complex viscosity of polymer solutions

He, Y., Li, L., Taniguchi, T., Tuinier, R. & Fan, T-H., 7 Jan 2020, In : Physical Review Fluids. 5, 1, 24 p., 013302.

Research output: Contribution to journalArticleAcademicpeer-review

Polymer Solution
Polymer solutions
Viscosity
Polymers
Depletion
1 Downloads (Pure)

Fluorene benzothiadiazole co-oligomer based aqueous self-assembled nanoparticles

Schill, J., Ferrazzano, L., Tolomelli, A., Schenning, A. P. H. J. & Brunsveld, L., 2 Jan 2020, In : RSC Advances. 10, 1, p. 444-450 7 p.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Oligomers
Nanoparticles
Energy transfer
Self assembly
Tuning
6 Downloads (Pure)

Fractography of poly(N-isopropylacrylamide) hydrogel networks crosslinked with mechanofluorophores using confocal laser scanning microscopy

Stratigaki, M., Baumann, C., van Breemen, L., Heuts, H., Sijbesma, R. & Göstl, R., 14 Jan 2020, In : Polymer Chemistry. 11, 2, p. 358-366 9 p.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Fractography
Hydrogels
Covalent bonds
Hydrogel
Confocal Microscopy

Fully renewable limonene-derived polycarbonate as a high-performance alkyd resin

Li, C., Veldhuis, T., Reuvers, B., Sablong, R. J. & Koning, C. E., 1 Jan 2020, In : Polymer International. 69, 1, p. 24-30 7 p.

Research output: Contribution to journalArticleAcademicpeer-review

polycarbonate
Alkyd resins
Polycarbonates
Fatty acids
Drying

Highly Efficient and Tunable Filtering of Electrons' Spin by Supramolecular Chirality of Nanofiber-Based Materials

Kulkarni, C., Mondal, A. K., Das, T. K., Grinbom, G., Tassinari, F., Mabesoone, M. F. J., Meijer, E. W. & Naaman, R., 1 Jan 2020, (Accepted/In press) In : Advanced Materials. 1904965.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
Magnetoelectronics
Chirality
Nanofibers
Electrons
Semiconducting organic compounds

Improving the physicochemical properties of Y zeolite for catalytic cracking of heavy oil via sequential steam-alkali-acid treatments

Aghaei, E., Karimzadeh, R., Godini, H. R., Gurlo, A. & Gorke, O., 1 Mar 2020, In : Microporous and Mesoporous Materials. 294, 15 p., 109854.

Research output: Contribution to journalArticleAcademicpeer-review

Zeolites
Catalytic cracking
Steam
Alkalies
steam

Increased activity in the oxygen evolution reaction by Fe4+-induced hole states in perovskite La1-xSrxFeO3

Shen, Z., Zhuang, Y., Li, W., Huang, X., Oropeza, F. E., Hensen, E. J. M., Hofmann, J. P., Cui, M., Tadich, A., Qi, D., Cheng, J., Li, J. & Zhang, K. H. L., 2020, (Accepted/In press) In : Journal of Materials Chemistry A.

Research output: Contribution to journalArticleAcademicpeer-review

Influence of experimental parameters on the formation and stability of silica-wax colloidosomes

Avossa, J. & Esteves, A. C. C., 1 Mar 2020, In : Journal of Colloid and Interface Science. 561, p. 244-256 13 p.

Research output: Contribution to journalArticleAcademicpeer-review

Waxes
Silicon Dioxide
Silica
Surface-Active Agents
Monolayers

In situ long-term membrane performance evaluation of hydrogen-bromine flow batteries

Hugo, Y. A., Kout, W., Sikkema, F., Borneman, Z. & Nijmeijer, K., 1 Feb 2020, In : Journal of Energy Storage. 27, 9 p., 101068.

Research output: Contribution to journalArticleAcademicpeer-review

Bromine
Membranes
Hydrogen
Degradation
Dissolution

In situ shell-isolated nanoparticle-enhanced raman spectroscopy of nickel-catalyzed hydrogenation reactions’

Wondergem, C. S., Kromwijk, J. J. G., Slagter, M. M., Vrijburg, W. L., Hensen, E. J. M., Monai, M., Vogt, C. & Weckhuysen, B. M., 2020, (Accepted/In press) In : ChemPhysChem.

Research output: Contribution to journalArticleAcademicpeer-review

1 Citation (Scopus)

Interaction of hydrogen with flat (0001) and corrugated (11–20) and (10–12) cobalt surfaces: insights from experiment and theory

Weststrate, C. J., Mahmoodinia, M., Farstad, M. H., Svenum, I. H., Strømsheim, M. D., Niemantsverdriet, J. W. & Venvik, H. J., 15 Feb 2020, In : Catalysis Today. 342, p. 124-130 7 p.

Research output: Contribution to journalArticleAcademicpeer-review

Cobalt
Hydrogen
Experiments
Atoms
Fischer-Tropsch synthesis
1 Downloads (Pure)
Open Access
File
Ethylene Glycol
Self assembly
Polyethylene glycols
Polymers
Organic solvents

Investigation of the active phase in K-promoted MoS2 catalysts for methanethiol synthesis

Yu, M., Kosinov, N. A., van Haandel, L., Kooyman, P. J. & Hensen, E. J. M., 2020, In : ACS Catalysis.

Research output: Contribution to journalArticleAcademicpeer-review

Carbon Monoxide
Catalysts
X ray photoelectron spectroscopy
Productivity
Transmission electron microscopy
12 Downloads (Pure)

Low-dose (S)TEM elemental analysis of water and oxygen uptake in beam sensitive materials

Leijten, Z. J. W. A., Wirix, M. J. M., Strauss, M., Plitzko, J. M., de With, G. & Friedrich, H., 1 Jan 2020, In : Ultramicroscopy. 208, 8 p., 112855.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Oxygen
Transmission electron microscopy
dosage
transmission electron microscopy
Water
1 Downloads (Pure)

Mechanistic role of protonated polar additives in ethanol for selective transformation of biomass-related compounds

Guo, H., Duereh, A., Su, Y-Q., Hensen, E. J. M., Qi, X. & Smith Jr., R. L., 5 May 2020, In : Applied Catalysis. B, Environmental. 264, 9 p., 118509.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
ethanol
Biomass
Ethanol
Dimethyl Sulfoxide
Dehydration
16 Downloads (Pure)

Mn promotion of rutile TiO2-RuO2 anodes for water oxidation in acidic media

Etzi Coller Pascuzzi, M., Goryachev, A., Hofmann, J. P. & Hensen, E. J. M., 1 Feb 2020, In : Applied Catalysis. B, Environmental. 261, 11 p., 118225.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
rutile
Anodes
oxidation
Oxidation
Water
4 Downloads (Pure)

Multi-component supramolecular fibers with elastomeric properties and controlled drug release

Putti, M., Mes, T., Huang, J., Bosman, A. W. & Dankers, P. Y. W., Jan 2020, In : Biomaterials Science. 8, 1, p. 163-173 11 p.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Pyrimidinones
Polyethylene glycols
Fibers
Pharmaceutical Preparations
Electrospinning
5 Downloads (Pure)

On the origin of dark current in organic photodiodes

Simone, G., Dyson, M. J., Weijtens, C. H. L., Meskers, S. C. J., Coehoorn, R., Janssen, R. A. J. & Gelinck, G. H., 1 Jan 2020, In : Advanced Optical Materials. 8, 1, 7 p., 1901568.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Dark currents
dark current
Photodiodes
photodiodes
Heterojunctions
2 Downloads (Pure)

Photo-substitution reactions of perylene red dyes

Lub, J., van Hal, P. A., Custers, E. M. G., Knobel, H. H. & Hikmet, R. A. M., 1 Feb 2020, In : Journal of Luminescence. 218, 116845.

Research output: Contribution to journalArticleAcademicpeer-review

Perylene
Acetic Acid
Substitution reactions
Ethanol
Coloring Agents

Porous nitrogen-doped carbon/carbon nanocomposite electrodes enable sodium ion capacitors with high capacity and rate capability

Yan, R., Leus, K., Hofmann, J. P., Antonietti, M. & Oschatz, M., Jan 2020, In : Nano Energy. 67, 8 p., 104240.

Research output: Contribution to journalArticleAcademicpeer-review

Energy storage
Nanocomposites
Capacitors
Nitrogen
Carbon
4 Downloads (Pure)

Proximity-induced caspase-9 activation on a DNA origami-based synthetic apoptosome

Rosier, B., Markvoort, B., Gumi Audenis, B., Roodhuizen, J., den Hamer, A., Brunsveld, L. & de Greef, T. F. A., 6 Jan 2020, In : Nature Catalysis. 12 p.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
Apoptosomes
Caspase 9
DNA
Protein Engineering
Multiprotein Complexes

Scaling method of CFD-DEM simulations for gas-solid flows in risers

Mu, L., Buist, K. A., Kuipers, J. A. M. & Deen, N. G., 1 Jan 2020, (Accepted/In press) In : Chemical Engineering Science: X. 100054.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
Flow of solids
Computational fluid dynamics
Gases
Hydrodynamics
Fluidized beds

Screening of functional solvent system for automatic aldehyde and ketone separation in aldol reaction: a combined COSMO-RS and experimental approach

Zhang, C., Song, Z., Jin, C., Nijhuis, J., Zhou, T., Noël, T., Gröger, H., Sundmacher, K., van Hest, J. & Hessel, V., 1 Apr 2020, In : Chemical Engineering Journal. 385, 10 p., 123399.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
ketone
aldehyde
Ketones
Aldehydes
Screening

Selective hydrogenation of 5 hydroxymethylfurfural and its acetal with 1,3-propanediol to 2,5-bis(hydroxymethyl)furan using supported rhenium-promoted nickel catalysts in water

Wiesfeld, J. J., Kim, M., Nakajima, K. & Hensen, E. J. M., 13 Jan 2020, (Accepted/In press) In : Green Chemistry.

Research output: Contribution to journalArticleAcademicpeer-review

4 Downloads (Pure)

Sorption enhanced dimethyl ether synthesis for high efficiency carbon conversion: modelling and cycle design

van Kampen, J., Boon, J., Vente, J. F. & van Sint Annaland, M., Apr 2020, In : Journal of CO2 Utilization. 37, p. 295-308 14 p.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
ether
Sorption
Ethers
Carbon
sorption

The butoxylation of dodecylamine: reaction mechanism and kinetics

Müller, P., Krösschell, R. D. E., Winkenwerder, W. & van der Schaaf, J., 15 Feb 2020, In : Chemical Engineering Journal. 382, 9 p., 122939.

Research output: Contribution to journalArticleAcademicpeer-review

Amines
kinetics
Kinetics
Hydroxyl Radical
Ethylene Oxide
6 Downloads (Pure)

The effect of supercritical CO2 on the permeation of dissolved water through PDMS membranes

Shamu, A., Miedema, H., Nijmeijer, K. & Borneman, Z., Jan 2020, In : Journal of CO2 Utilization. 35, p. 145-152 8 p.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Polydimethylsiloxane
Permeation
membrane
Membranes
Water

Three-dimensional hierarchical CuxS-based evaporator for high-efficiency multifunctional solar distillation

Huang, W., Su, P., Cao, Y., Li, C., Chen, D., Tian, X., Su, Y., Qiao, B., Tu, J. & Wang, X., Mar 2020, In : Nano Energy. 69, 104465.

Research output: Contribution to journalArticleAcademicpeer-review

Evaporators
Distillation
Water
Foams
Evaporation
1 Citation (Scopus)
5 Downloads (Pure)

Understanding the role of the porous electrode microstructure in redox flow battery performance using an experimentally validated 3D pore-scale lattice Boltzmann model

Zhang, D., Forner-Cuenca, A., Taiwo, O. O., Yufit, V., Brushett, F. R., Brandon, N. P., Gu, S. & Cai, Q., 31 Jan 2020, In : Journal of Power Sources. 447, 13 p., 227249.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
electric batteries
porosity
microstructure
Microstructure
Electrodes
2019
6 Citations (Scopus)
1 Downloads (Pure)
Signal filtering and prediction
Furaldehyde
Furfural
Eutectics
Sugars
6 Citations (Scopus)
20 Downloads (Pure)

3D helix engineering in chiral photonic materials

Kragt, A. J. J., Hoekstra, D. C., Stallinga, S., Broer, D. J. & Schenning, A. P. H. J., Aug 2019, In : Advanced Materials. 31, 33, 1903120.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Photonics
Light polarization
Nematic liquid crystals
Polymer films
Cryptography