Dr Edo Boek
School of Engineering and Materials Science
Queen Mary University of London
Queen Mary University of London
Publications
Publications of specific relevance to the Centre for Sustainable Engineering2026
Prediction of asphaltene deposition risk in CO2-EOR using Hansen solubility parameters by molecular dynamics simulationHuang Y Liang Y Tsuji T Cui W Masuda Y Matsuoka T Boek ES Suzuki T et al.
Fuel, Elsevier vol. 404
01-01-2026
2025
Compressibility and permeability of flocculated microalgal sediment in filtration-permeationWu J Cagney N Jones TGJ Boek ES
Journal of Water Process Engineering vol. 74, 107795-107795.
01-05-2025
Membrane fouling during the harvesting of microalgae using static microfiltrationWu J Meeten GH Jones TGJ Cagney N
Separation and Purification Technology, Elsevier vol. 353, 127737-127737.
01-01-2025
2024
Membrane fouling and filtercake formation during static microfiltration harvesting of microalgae using thin glass fibre filtersWu J Meeten G Boek E Cagney N
The 16th Annual InterPore Meeting, InterPore2024 Qingdao, China.
31-03-2024
Transition from oil & gas drilling fluids to geothermal drilling fluidsCollins IR Floriano DC Wee J
Geoenergy Science and Engineering, Elsevier vol. 233, 212543-212543.
01-02-2024
2023
Spatial Characterization of Wetting in Porous Media Using Local Lattice-Boltzmann SimulationsErfani H Haghani R McClure J Berg CF
Transport in Porous Media, Springer Nature vol. 151 (3), 429-448.
24-12-2023
Evaluation of Asphaltene Hildebrand and Hansen Solubility Parameters Using Digital Oil Models with Molecular Dynamics SimulationHuang Y Liang Y Masuda Y Cui W Boek ES Takabayashi K
Energy & Fuels, American Chemical Society (Acs) vol. 37 (19), 14699-14713.
18-09-2023
Investigation of membrane fouling in microfiltration harvesting of microalgae: Nannochloropsis oculataWu J Boek E
71st British Phycological Society Winter Meeting 2023 Newcastle University, UK 24 Jan 2023 - 27 Jan 2023. (No. 104 Spring 2023)
01-03-2023
2022
Microstructural evolution of bitumen during the glass transition: An application of digital oilCui W Huo K Sugiyama S Liang Y Masuda Y Morimoto M Boek ES Kaito Y
Fuel, Elsevier vol. 335
14-12-2022
Extension of the TraPPE Force Field for Battery Electrolyte Solvents.Luo Z Burrows SA Fan X Boek ES
Journal of Physical Chemistry B (Soft Condensed Matter and Biophysical Chemistry), American Chemical Society
03-10-2022
An insight review on formation damage induced by drilling fluidsKalhor Mohammadi M Riahi S
Reviews in Chemical Engineering, De Gruyter
26-01-2022
2021
Developing novel bio-nano catalyst well clean up fluid to remove formation damage induced by polymeric water-based drilling fluidsKalhor Mohammadi M Riahi S
Journal of Petroleum Science and Engineering, Elsevier vol. 210
02-12-2021
Simulating volume-controlled invasion of a non-wetting fluid in volumetric images using basic image processing toolsGostick JT Misaghian N Yang J
Computers and Geosciences, Elsevier vol. 158
06-11-2021
Virtual voids method to generate low-density microporous carbon structures using quenched molecular dynamics simulationLuo Z Burrows SA Fan X Smoukov SK
Carbon vol. 183, 438-448.
15-10-2021
Fluidisation characteristics of granular activated carbon in drinking water treatment applicationsKramer OJI van Schaik C Dacomba-Torres PDR de Moel PJ
Advanced Powder Technology vol. 32 (9), 3174-3188.
01-09-2021
Experimental and numerical insights into heterogeneous liquid-solid behaviour in drinking water softening reactorsNijssen TMJ Kramer OJI de Moel PJ Rahman J Kroon JP Berhanu P Boek ES Buist KA et al.
Chemical Engineering Science: X vol. 11
01-08-2021
Pore-scale dissolution mechanisms in calcite-COGray F Anabaraonye BU Crawshaw JP
Geochimica Et Cosmochimica Acta vol. 305, 323-338.
15-07-2021
A novel sensor measuring local voidage profile inside a fluidised bed reactorKramer OJI van Schaik C Hangelbroek JJ de Moel PJ Colin MG Amsing M Boek ES
Journal of Water Process Engineering
02-06-2021
New hydraulic insights into rapid sand filter bed backwashing using the Carman–Kozeny modelKramer OJI de Moel PJ Padding JT Baars ET Elarbab AHE Boek ES
Water Research, Elsevier vol. 197
23-03-2021
Simulating volume-controlled invasion of a non-wetting fluid in volumetric images using basic image processing toolsGostick JT Yang J
In Arxiv
08-01-2021
2020
Pore-Scale Modeling of Drainage Displacement Patterns in Association With Geological Sequestration of CO2Zacharoudiou I Boek ES
Water Resources Research vol. 56 (11)
01-11-2020
Investigation of viscous coupling effects in three-phase flow by lattice Boltzmann direct simulation and machine learning techniqueJiang F Yang J Boek E Tsuji T
Advances in Water Resources, Elsevier vol. 147
29-10-2020
Accurate voidage prediction in fluidisation systems for full-scale drinking water pellet softening reactors using data driven modelsKramer OJI de Moel PJ Padding JT Baars ET Boek ES
Journal of Water Process Engineering, Elsevier vol. 37
01-07-2020
Improvement of voidage prediction in liquid-solid fluidized beds by inclusion of the Froude number in effective drag relationsKramer OJI Padding JT van Vugt WH de Moel PJ
International Journal of Multiphase Flow, Elsevier vol. 127
01-06-2020
2019
Application of a Digital Oil Model to Solvent-Based Enhanced Oil Recovery of Heavy Crude OilIwase M Liang Y Masuda Y Morimoto M Matsuoka T Kaito Y
Energy and Fuels, American Chemical Society
17-10-2019
Catalogue of Plausible Molecular Models for the Molecular Dynamics of Asphaltenes and Resins Obtained from Quantitative Molecular RepresentationLaw JC Headen TF Jiménez-Serratos G Boek ES Murgich J
Energy & Fuels, American Chemical Society (Acs) vol. 33 (10), 9779-9795.
19-09-2019
Image-based simulations of absolute permeability with massively parallel pseudo-compressible stabilised finite element solverYang L Yang J Pain C
Computational Geosciences, Springer Science and Business Media Llc
17-06-2019
2018
The impact of drainage displacement patterns and Haines jumps on CO2 storage efficiencyZacharoudiou I Boek ES Crawshaw J
Scientific Reports vol. 8 (1)
01-12-2018
Chemical mechanisms of dissolution of calcite by HCl in porous media: Simulations and experimentGray F Shah S Boek E
Advances in Water Resources vol. 121, 369-387.
01-11-2018
Construction, validation, and application of digital oil: Investigation of asphaltene association toward asphaltene-precipitation predictionSugiyama S Liang Y Murata S Matsuoka T Morimoto M Ohata T
Spe Journal vol. 23 (3), 952-968.
01-06-2018
Construction, Validation, and Application of Digital Oil: Investigation of Asphaltene Association Toward Asphaltene-Precipitation PredictionSugiyama S Liang Y Murata S Matsuoka T Morimoto M Ohata T Boek ES
Society of Petroleum Engineers Journal, Society of Petroleum Engineers (Spe) vol. 23 (03), 952-968.
06-02-2018
2017
Development of Digital Oil for Heavy Crude Oil: Molecular Model and Molecular Dynamics SimulationsIwase M Sugiyama S Liang Y Masuda Y Boek ES Ueda R
Energy and Fuels vol. 32 (3), 2781-2792.
22-12-2017
Experimental Study on Kinetics of Asphaltene Aggregation in a MicrocapillaryLi X Guo Y Guo X
Energy and Fuels vol. 31 (9), 9006-9015.
21-09-2017
Pore-filling events in single junction micro-models with corresponding lattice Boltzmann simulationsZacharoudiou I Chapman EM Crawshaw JP
Journal of Fluid Mechanics vol. 824, 550-573.
06-07-2017
Multiphase-flow and reactive-transport validation studies at the pore scale by use of lattice Boltzmann computer simulationsBoek ES Zacharoudiou I Gray F Crawshaw JP
SPE ATCE. vol. 22 (3), 940-949.
01-06-2017
High-Resolution 3D FIB-SEM Image Analysis and Validation of Numerical Simulations of Nanometre-Scale Porous Ceramic with Comparisons to Experimental ResultsWelch NJ Gray F Butcher AR Crawshaw JP
Transport in Porous Media, Springer Verlag vol. 118 (3), 373-392.
04-05-2017
Convex hull approach for determining rock representative elementary volume for multiple petrophysical parameters using pore-scale imaging and Lattice–Boltzmann modellingShah SM Gray F Yang J
Advances in Water Resources, Elsevier vol. 104, 65-75.
14-03-2017
Simulation of Asphaltene Aggregation through Molecular Dynamics: Insights and LimitationsHeaden TF Boek ES Jackson G Müller EA
Energy and Fuels, American Chemical Society vol. 31 (2), 1108-1125.
03-01-2017
Chapter 10 Progress in Computer Simulations of Wormlike Micellar FluidsBoek ES
In Wormlike Micelles, Royal Society of Chemistry (Rsc) 279-297.
01-01-2017
2016
Construction of Digital Oil for Investigation of Crude Oil Properties at Different Thermodynamic ConditionsSugiyama S Liang Y Murata S Matsuoka T Ohata T
International Petroleum Technology Conference.
12-11-2016
Three-dimensional imaging of porous media using confocal laser scanning microscopy.Shah SM Crawshaw JP
Journal of Microscopy, Wiley vol. 265 (2), 261-271.
25-10-2016
Simulation of dissolution in porous media in three dimensions with lattice Boltzmann, finite-volume, and surface-rescaling methods.Gray F Cen J Boek ES
Phys Rev E vol. 94 (4-1), 043320-043320.
25-10-2016
Rheology and Phase Behavior of Carbon Dioxide and Crude Oil MixturesHu R Crawshaw JP Trusler JPM
Energy and Fuels, American Chemical Society vol. 31 (6), 5776-5784.
22-09-2016
Micro-computed tomography pore-scale study of flow in porous media: Effect of voxel resolutionShah SM Gray F Crawshaw JP
Advances in Water Resources vol. 95, 276-287.
01-09-2016
Simulating dispersion in porous media and the influence of segmentation on stagnancy in carbonatesGray F Cen J Boek ES
Advances in Water Resources, Elsevier vol. 97, 1-10.
25-08-2016
Changes in the interlayer structure and thermodynamics of hydrated montmorillonite under basin conditions: Molecular simulation approachesZhou J Boek ES
Clays and Clay Minerals, Clay Minerals Society vol. 64 (4), 503-511.
01-08-2016
Molecular Dynamics Simulations of Slip on Curved SurfacesRoss DA Boek ES
Oil & Gas Science and Technology – Revue D’Ifp Energies Nouvelles, Edp Sciences vol. 71 (4)
23-06-2016
Capillary filling and Haines jump dynamics using free energy Lattice Boltzmann simulationsZacharoudiou I
Advances in Water Resources vol. 92, 43-56.
01-04-2016
Confined water in tunnel nanopores of sepiolite: Insights from molecular simulationsZhou J Boek ES
American Mineralogist, Mineralogical Society of America vol. 101 (3), 713-718.
01-03-2016
Enhancing Computational Precision for Lattice Boltzmann Schemes in Porous Media FlowsGray F Boek E
Computation, Mdpi vol. 4 (1)
17-02-2016
Adsorption of asphaltenes on the calcite (10.4) surface by first-principles calculationsAlvim RS Lima FCDA Sánchez VM Headen TF
Rsc Advances, Royal Society of Chemistry (Rsc) vol. 6 (97), 95328-95336.
01-01-2016
2015
Molecular Simulation Study of Hydrated Na-RectoriteZhou J Boek ES Zhu J Sprik M
Langmuir, American Chemical Society (Acs) vol. 31 (6), 2008-2013.
04-02-2015
2014
Investigation of Asphaltene-Asphaltene Association and Aggregation for Compositional Reservoir Simulators By Quantitative Molecular RepresentationsHibi R Tagami K Kobayashi K Liang Y Honda H Murata S Matsuoka T Morimoto M
International Petroleum Technology Conference.
10-12-2014
Rheology of Diluted Heavy Crude Oil Saturated with Carbon DioxideHu R Crawshaw JP Boek ES
Energy & Fuels, American Chemical Society (Acs) vol. 29 (5), 2785-2789.
17-11-2014
Preparation of microporous rock samples for confocal laser scanning microscopyShah SM Crawshaw JP
Petroleum Geoscience, Geological Society of London vol. 20 (4), 369-374.
28-10-2014
Multiphase Flow and Reactive Transport at the Pore Scale Using Lattice-Boltzmann Computer SimulationsBoek ES Zacharoudiou I Gray F Shah SM
SPE Annual Technical Conference and Exhibition.
27-10-2014
Molecular dynamics simulations of interlayer structure and mobility in hydrated Li-, Na- and K-montmorillonite claysBoek ES
Molecular Physics, Taylor & Francis vol. 112 (9-10), 1472-1483.
13-05-2014
2013
12. Multi-scale Imaging and Simulation of Structure, Flow and Reactive Transport for C02 Storage and EOR in Carbonate ReservoirsCrawshaw JP
In Geochemistry of Geologic Co2 Sequestration, De Gruyter 431-458.
31-12-2013
Quantitative determination of molecular propagator distributions for solute transport in homogeneous and heterogeneous porous media using lattice Boltzmann simulationsYang J Crawshaw J
Water Resources Research, American Geophysical Union (Agu) vol. 49 (12), 8531-8538.
01-12-2013
Predicting Porosity and Permeability of Carbonate Rocks From Core-Scale to Pore-Scale Using Medical CT, Confocal Laser Scanning Microscopy and Micro CTShah SM Yang J Gharbi O
SPE Annual Technical Conference and Exhibition.
30-09-2013
Asphaltene Deposition in Capillary FlowSeifried CM Al Lawati S
SPE Annual Technical Conference and Exhibition.
30-09-2013
Molecular Dynamics Simulations of CO2 and Brine Interfacial Tension at High Temperatures and PressuresLi X Ross DA Trusler JPM
The Journal of Physical Chemistry B, American Chemical Society (Acs) vol. 117 (18), 5647-5652.
30-04-2013
A comparison study of multi-component Lattice Boltzmann models for flow in porous media applicationsYang J
Computers & Mathematics with Applications. vol. 65 (6), 882-890.
01-03-2013
Kinetics of Asphaltene Aggregation in Crude Oil Studied by Confocal Laser-Scanning MicroscopySeifried CM Crawshaw J Boek ES
Energy & Fuels. vol. 27 (4), 1865-1872.
20-02-2013
Molecular Dynamics Simulations of Asphaltenes at the Oil–Water Interface: From Nanoaggregation to Thin-Film FormationMikami Y Liang Y
Energy & Fuels. vol. 27 (4), 1838-1845.
16-01-2013
Multi-scale Imaging and Simulation of Structure, Flow and Reactive Transport for CO2 Storage and EOR in Carbonate ReservoirsCrawshaw JP
Reviews in Mineralogy and Geochemistry, Mineralogical Society of America vol. 77 (1), 431-458.
01-01-2013
Pore Scale Models for Imbibition of CO2 Analogue Fluids in Etched Micro-model||junctions Using Micro-fluidic Experiments and Direct Flow CalculationsChapman EM Yang J
Energy Procedia. vol. 37, 3680-3686.
01-01-2013
Changes in Pore Structure and Connectivity Induced by CO2 Injection in Carbonates: A Combined Pore-Scale ApproachGharbi O Bijeljic B Boek E
Energy Procedia. vol. 37, 5367-5378.
01-01-2013
2012
Molecular Dynamics Simulation of Spontaneous Imbibition in Nanopores and Recovery of Asphaltenic Crude Oils Using Surfactants for EOR ApplicationsStukan MR Boek ES
Oil & Gas Science and Technology – Revue D’Ifp Energies Nouvelles, Edp Sciences vol. 67 (5), 737-742.
01-09-2012
Free energies of absorption of alkali ions onto beidellite and montmorillonite surfaces from constrained molecular dynamics simulationsSuter JL Sprik M
Geochimica Et Cosmochimica Acta, Elsevier vol. 91, 109-119.
01-08-2012
Systematic Optimization of Asphaltene Molecular Structure and Molecular Weight Using the Quantitative Molecular Representation ApproachAl Halwachi HK Yakovlev DS Boek ES
Energy & Fuels, American Chemical Society (Acs) vol. 26 (10), 6177-6185.
01-08-2012
Experimental Investigation of Asphaltene Deposition in Capillary FlowLawal KA Crawshaw JP Boek ES
Energy & Fuels, American Chemical Society (Acs) vol. 26 (4), 2145-2153.
11-04-2012
Interfacial Tension of (Brines + CO2): CaCl2(aq), MgCl2(aq), and Na2SO4(aq) at Temperatures between (343 and 423) K, Pressures between (2 and 50) MPa, and Molalities of (0.5 to 5) mol·kg–1Li X Boek ES Maitland GC
Journal of Chemical & Engineering Data, American Chemical Society (Acs) vol. 57 (5), 1369-1375.
06-04-2012
12th International Conference on Petroleum Phase Behavior and FoulingBoek ES
Energy & Fuels, American Chemical Society (Acs) vol. 26 (5), 2547-2547.
28-03-2012
Error analysis and correction for Lattice Boltzmann simulated flow conductance in capillaries of different shapes and alignmentsSengupta A Hammond PS Frenkel D
Journal of Computational Physics, Elsevier vol. 231 (6), 2634-2640.
01-03-2012
Interfacial Tension of (Brines + CO2): (0.864 NaCl + 0.136 KCl) at Temperatures between (298 and 448) K, Pressures between (2 and 50) MPa, and Total Molalities of (1 to 5) mol·kg–1Li X Boek E Maitland GC
Journal of Chemical & Engineering Data, American Chemical Society (Acs) vol. 57 (4), 1078-1088.
01-03-2012
2011
Molecular dynamics simulation of surfactant flooding in asphaltenic oils for EOR applicationsBoek ES Stukan MR
16th European Symposium on Improved Oil Recovery 2011., 668-676.
01-12-2011
Precipitation of asphaltene from crude oil using filtration experimentsXu X Crawshaw JP
16th European Symposium on Improved Oil Recovery 2011., 300-308.
01-12-2011
Modeling Permeability Impairment in Porous Media due to Asphaltene Deposition under Dynamic ConditionsLawal KA Vesovic V Boek ES
Energy & Fuels, American Chemical Society (Acs) vol. 25 (12), 5647-5659.
23-11-2011
Prediction of Asphaltene Deposition in Porous Media by Systematic Upscaling from a Colloidal Pore Scale Model to a Deep Bed Filtration ModelBoek E Fadili A Padding J
SPE Annual Technical Conference and Exhibition.
30-10-2011
Deep Bed Filtration Modelling of Formation Damage Due to Particulate Invasion from Drilling FluidsBoek ES Hall C Tardy PMJ
Transport in Porous Media, Springer Nature vol. 91 (2), 479-508.
28-09-2011
2010
Potential of Mean Force Calculation from Molecular Dynamics Simulation of Asphaltene Molecules on a Calcite SurfaceHeaden TF Boek ES
Energy & Fuels. vol. 25 (2), 499-502.
13-12-2010
Molecular Dynamics Simulations of Asphaltene Aggregation in Supercritical Carbon Dioxide with and without LimoneneHeaden TF Boek ES
Energy & Fuels. vol. 25 (2), 503-508.
07-12-2010
Pore Scale Simulation of Flow in Porous Media Using Lattice-Boltzmann Computer SimulationsBoek E
SPE Annual Technical Conference and Exhibition.
19-09-2010
Spontaneous Imbibition in Nanopores of Different Roughness and WettabilityStukan MR Ligneul P Crawshaw JP
Langmuir, American Chemical Society (Acs) vol. 26 (16), 13342-13352.
23-07-2010
Lattice-Boltzmann studies of fluid flow in porous media with realistic rock geometriesBoek ES Venturoli M
Computers & Mathematics With Applications, Elsevier vol. 59 (7), 2305-2314.
01-04-2010
Multi-scale simulation of asphaltene aggregation and deposition in capillary flowBoek ES Headen TF
Faraday Discussions, Royal Society of Chemistry (Rsc) vol. 144, 271-284.
01-01-2010
2009
Multi-scale Simulation and Experimental Studies of Asphaltene Aggregation and Deposition in Capillary FlowBoek ES Wilson AD Padding JT Headen TF
Energy & Fuels. vol. 24 (4), 2361-2368.
21-12-2009
Recent Developments in the Deposition of Colloidal Asphaltene in Capillary Flow: Experiments and Mesoscopic SimulationWilson AD Boek ES Ladva HK
8th European Formation Damage Conference.
27-05-2009
Quantitative Molecular Representation of Asphaltenes and Molecular Dynamics Simulation of Their AggregationBoek ES Yakovlev DS
Energy & Fuels. vol. 23 (3), 1209-1219.
17-02-2009
Evidence for Asphaltene Nanoaggregation in Toluene and Heptane from Molecular Dynamics SimulationsHeaden TF Boek ES
Energy & Fuels. vol. 23 (3), 1220-1229.
02-02-2009
Review of multi-scale particulate simulation of the rheology of wormlike micellar fluidsPadding JT Briels WJ Stukan MR
Soft Matter, Royal Society of Chemistry (Rsc) vol. 5 (22), 4367-4375.
01-01-2009
2008
Small Angle Neutron Scattering (SANS and V-SANS) Study of Asphaltene Aggregates in Crude OilHeaden TF Boek ES Stellbrink J
Langmuir, American Chemical Society (Acs) vol. 25 (1), 422-428.
08-12-2008
Adsorption of a Sodium Ion on a Smectite Clay from Constrained Ab Initio Molecular Dynamics SimulationsSuter JL Boek ES
The Journal of Physical Chemistry C, American Chemical Society (Acs) vol. 112 (48), 18832-18839.
07-11-2008
Dynamics and rheology of wormlike micelles emerging from particulate computer simulationsPadding JT Boek ES
The Journal of Chemical Physics, Aip Publishing vol. 129 (7)
18-08-2008
Colloidal Asphaltene Deposition and Aggregation in Capillary Flow: Experiments and Mesoscopic SimulationBoek ES Ladva HK Crawshaw JP Padding JT Leal GL Giacomin AJ
AIP Conference Proceedings. vol. 1027 (1), 273-275.
07-07-2008
Influence of system size and solvent flow on the distribution of wormlike micelles in a contraction-expansion geometryStukan MR Boek ES Padding JT
The European Physical Journal E, Springer Nature vol. 26 (1-2)
22-04-2008
Deposition of Colloidal Asphaltene in Capillary Flow: Experiments and Mesoscopic SimulationBoek ES Ladva HK Crawshaw JP
Energy & Fuels, American Chemical Society (Acs) vol. 22 (2), 805-813.
01-03-2008
Flow of wormlike micelles in an expansion-contraction geometryStukan MR Padding JT Briels WJ
Soft Matter, Royal Society of Chemistry (Rsc) vol. 4 (4), 870-879.
01-01-2008
2007
Flow of entangled wormlike micellar fluids: Mesoscopic simulations, rheology and μ-PIV experimentsBoek ES Padding JT Anderson VJ Briels WJ
Journal of Non-Newtonian Fluid Mechanics, Elsevier vol. 146 (1-3), 11-21.
01-10-2007
Molecular Dynamics Simulations of Mixed Cationic/Anionic Wormlike MicellesYakovlev DS
Langmuir, American Chemical Society (Acs) vol. 23 (12), 6588-6597.
04-05-2007
2006
Two-dimensional lattice-Boltzmann simulations of single phase flow in a pseudo two-dimensional micromodelVenturoli M Boek ES
Physica a Statistical Mechanics and Its Applications, Elsevier vol. 362 (1), 23-29.
01-03-2006
CECAM Workshop on “Structure and Rheology of Self-Assembling and Aggregating Colloidal Suspensions: Theory, Simulation and Experiment”Boek ES Padding JT
Applied Rheology. vol. 16 (1), 35-36.
01-02-2006
Molecular order and disorder of surfactants in clay nanocompositesTambach TJ Boek ES
Physical Chemistry Chemical Physics, Royal Society of Chemistry (Rsc) vol. 8 (23), 2700-2702.
01-01-2006
2005
Rheology of wormlike micellar fluids from Brownian and molecular dynamics simulationsPadding JT Boek ES
Journal of Physics Condensed Matter, Iop Publishing vol. 17 (45)
28-10-2005
Mechanical Properties of Surfactant Bilayer Membranes from Atomistic and Coarse-Grained Molecular Dynamics SimulationsBoek ES Padding JT Otter WKD
The Journal of Physical Chemistry B, American Chemical Society (Acs) vol. 109 (42), 19851-19858.
29-09-2005
Constitutive equations for extensional flow of wormlike micelles: stability analysis of the Bautista–Manero modelBoek ES Padding JT Anderson VJ Tardy PMJ
Journal of Non-Newtonian Fluid Mechanics, Elsevier vol. 126 (1), 39-46.
01-02-2005
2004
Influence of shear flow on the formation of rings in wormlike micelles: A nonequilibrium molecular dynamics studyPadding JT
Physical Review E, American Physical Society (Aps) vol. 70 (3)
01-09-2004
Moleculardynamics simulation of amphiphilic bilayer membranes and wormlike micelles: a multiscale modelling approach to the design of viscoelastic surfactant solutionsBoek ES Otter WKD Briels WJ
Philosophical Transactions of The Royal Society a Mathematical Physical and Engineering Sciences, The Royal Society vol. 362 (1821), 1625-1638.
02-06-2004
Structural and dynamical characterization of HeleShaw viscous fingeringGrosfils P Boon JP Chin J Boek ES
Philosophical Transactions of The Royal Society a Mathematical Physical and Engineering Sciences, The Royal Society vol. 362 (1821), 1723-1734.
02-06-2004
Evidence for diffusion-controlled recombination kinetics in model wormlike micellesPadding JT
Epl (Europhysics Letters), Iop Publishing vol. 66 (5), 756-762.
01-06-2004
2003
Ab Initio Molecular Dynamics Study of the Hydration of a Sodium Smectite ClayBoek ES Sprik M
The Journal of Physical Chemistry B, American Chemical Society (Acs) vol. 107 (14), 3251-3256.
19-03-2003
Lattice Boltzmann simulation of the flow of non-Newtonian fluids in porous mediaBoek ES Chin J
International Journal of Modern Physics B. vol. 17 (1-2), 99-102.
20-01-2003
LATTICE BOLTZMANN SIMULATION OF THE FLOW OF NON-NEWTONIAN FLUIDS IN POROUS MEDIABOEK ES CHIN J
International Journal of Modern Physics B. vol. 17 (01n02), 99-102.
20-01-2003
Structure of Bilayer Membranes of Gemini Surfactants with Rigid and Flexible Spacers from MD SimulationsYakovlev D
Lecture Notes in Computer Science, Springer Nature vol. 2658, 668-677.
01-01-2003
2002
Molecular design of responsive fluids: molecular dynamics studies of viscoelastic surfactant solutionsBoek ES Jusufi A Löwen H
Journal of Physics Condensed Matter, Iop Publishing vol. 14 (40)
26-09-2002
Lattice Boltzmann simulation of the flow of binary immiscible fluids with different viscosities using the Shan-Chen microscopic interaction modelChin J Boek ES
Philosophical Transactions of The Royal Society a Mathematical Physical and Engineering Sciences, The Royal Society vol. 360 (1792), 547-558.
15-03-2002
Ab initio molecular dynamics study of a model swelling smectite clay.Sprik M
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY. vol. 223, U616-U616.
01-01-2002
Novel non-exfoliated clay-nanocomposite materials by in situ co-polymerisation of intercalated monomers: A combinatorial discovery approachCoveney PV Griffin JLW WATKINSON M Boek ES
Mol. Sim. vol. 28 (3), 295-316.
01-01-2002
2001
Rheology of Dilute Suspensions of Hard Platelike Colloidsvan der Kooij FM Boek ES Philipse AP
Journal of Colloid and Interface Science, Elsevier vol. 235 (2), 344-349.
01-03-2001
Molecular Modelling of The Mechanism of Action of Organic Clay-Swelling InhibitorsBains AS Boek ES Coveney PV Williams SJ
Molecular Simulation, Taylor & Francis vol. 26 (2), 101-145.
01-02-2001
2000
Particulate Invasion From Drilling FluidsBailey L Boek ES Boassen T Selle OM Longeron DG
Society of Petroleum Engineers Journal, Society of Petroleum Engineers (Spe) vol. 5 (04), 412-419.
01-12-2000
Novel Approaches to Cross-linking High Molecular Weight Polysaccharides: Application to Guar-based Hydraulic Fracturing FluidsCoveney PV de Silva H Gomtsyan A Whiting A
Molecular Simulation, Taylor & Francis vol. 25 (5), 265-299.
01-10-2000
Structure and phase behavior of a model clay dispersion: A molecular-dynamics investigationKutter S Hansen J-P Sprik M
The Journal of Chemical Physics, Aip Publishing vol. 112 (1), 311-322.
01-01-2000
1999
Explanation for the supersaturation dependence of the morphology of lysozyme crystalsGrimbergen RFP Boek ES Bennema P
Journal of Crystal Growth, Elsevier vol. 207 (1-2), 112-121.
01-11-1999
Particulate invasion from drilling fluidsBailey L Boek E Jacques S Boassen T Selle O
Spe European Formation Damage Control Conference Proceedings, 471-480.
01-01-1999
1998
Resolution Effects in Dissipative Particle Dynamics SimulationsBoek ES Van Der Schoot P
International Journal of Modern Physics C, World Scientific Publishing vol. 9 (08), 1307-1318.
01-12-1998
Computer simulation evidence for enthalpy driven dehydration of smectite clays at elevated pressures and temperaturesDe Siqueira AVC Skipper NT Coveney PV Boek ES
Molecular Physics, Taylor & Francis vol. 95 (1), 123-123.
01-09-1998
1997
Computer simulation evidence for enthalpy driven dehydration of smectite clays at elevated pressures and temperaturesDE SIQUEIRA AVC
Molecular Physics, Taylor & Francis vol. 92 (1), 1-6.
01-09-1997
Simulating the rheology of dense colloidal suspensions using dissipative particle dynamicsBoek ES Coveney PV van der Schoot P
Physical Review E, American Physical Society (Aps) vol. 55 (3), 3124-3133.
01-03-1997
Simulating the rheology of dense colloidal suspensions using dissipative particle dynamicsBoek ES Coveney PV
Physical Review E vol. 55 (3), 3124-3133.
01-01-1997
1996
Computer simulation of rheological phenomena in dense colloidal suspensions with dissipative particle dynamicsBoek ES Coveney PV Lekkerkerker HNW
Journal of Physics Condensed Matter, Iop Publishing vol. 8 (47)
18-11-1996
A Robust Water Potential ParameterisationBoek ES Coveney PV Williams SJ
Molecular Simulation, Taylor & Francis vol. 18 (3), 145-154.
01-10-1996
1995
Molecular Modeling of Clay Hydration: A Study of Hysteresis Loops in the Swelling Curves of Sodium MontmorillonitesBoek ES Coveney PV Skipper NT
Langmuir, American Chemical Society (Acs) vol. 11 (12), 4629-4631.
01-12-1995
Monte Carlo Molecular Modeling Studies of Hydrated Li-, Na-, and K-Smectites: Understanding the Role of Potassium as a Clay Swelling InhibitorBoek ES Coveney PV
Journal of The American Chemical Society, American Chemical Society (Acs) vol. 117 (50), 12608-12617.
01-12-1995
Analysis of morphology of crystals based on identification of interfacial structureLiu XY Boek ES Briels WJ
The Journal of Chemical Physics, Aip Publishing vol. 103 (9), 3747-3754.
01-09-1995
Prediction of crystal growth morphology based on structural analysis of the solid–fluid interfaceLiu XY Boek ES Briels WJ
Nature, Springer Nature vol. 374 (6520), 342-345.
01-03-1995
1994
Interfaces between a Saturated Aqueous Urea Solution and Crystalline Urea: A Molecular Dynamics StudyBoek ES Briels WJ
The Journal of Physical Chemistry, American Chemical Society (Acs) vol. 98 (6), 1674-1681.
01-02-1994
1993
Molecular dynamics simulations of aqueous urea solutions: Study of dimer stability and solution structure, and calculation of the total nitrogen radial distribution function G N( r )Boek ES
The Journal of Chemical Physics, Aip Publishing vol. 98 (2), 1422-1427.
15-01-1993
1992
Molecular-dynamics simulations of interfaces between water and crystalline ureaBoek ES Briels WJ Feil D
The Journal of Chemical Physics, Aip Publishing vol. 96 (9), 7010-7018.
01-05-1992
1991
From wave function to crystal morphology: application to urea and alpha-glycineBoek ES Feil D Briels WJ
Journal of Crystal Growth, Elsevier vol. 114 (3), 389-410.
01-11-1991
1989
δ-electron spectroscopy, a tool to study the dynamics of heavy-ion collisionsKrämer M Blank B Boek E Ditzel E Kankeleit E Klotz-Engmann G Müntz C
Physical Review C, American Physical Society (Aps) vol. 40 (4), 1662-1676.
01-10-1989
1986
Reaction dynamics studied via positron and electron spectroscopyKrieg R Boek E Gollerthan U Kankeleit E Krämer M
Physical Review C, American Physical Society (Aps) vol. 34 (2), 562-575.
01-08-1986
1985
Strong Angular Momentum Effects in Near-Barrier Fusion ReactionsHaas B Duchêne G Beck FA Byrski T Gehringer C Merdinger JC Nourredine A Vivien JP et al.
Physical Review Letters, American Physical Society (Aps) vol. 54 (5), 398-401.
04-02-1985
1975
Hyperfine interactions of light nuclei recoil-implanted into ironBożek E Hrynkiewicz AZ Merdinger JC
Physical Review C, American Physical Society (Aps) vol. 12 (6), 1873-1877.
01-12-1975
1967
Analysis of morphology of crystals based on identification of interfacial structureLiu XY Boek ES Briels WJ
Physics of Fluids vol. 10 (11), 3747-3754.
01-12-1967
Benchmarking of Molecular Dynamics Force Fields for Solid−Liquid and Solid−Solid Phase Transitions in AlkanesSmoukov S Burrows S Karabasov S Korotkin I Boek E
The Journal of Physical Chemistry B: Biophysical Chemistry, Biomaterials, Liquids, and Soft Matter, American Chemical Society
Grants of specific relevance to the Centre for Sustainable Engineering
Grants of specific relevance to the Centre for Sustainable EngineeringAqualunar Challenge Prize - Runner-Up PrizeEdo Boek and Stoyan Smoukov
£50,000 Challenge Works
01-04-2025 - 31-03-2026
Combined foam fractionation and downflow filtration rig for PFAS removal and destructionEdo Boek
£10,000 Mineral Technologies Inc
01-01-2024 - 31-12-2025
Utilisation of Synthetic Fuels for “Difficult-to-Decarbonise” PropulsionXi Jiang, Nader Karimi and Edo Boek
£436,930 EPSRC Engineering and Physical Sciences Research Council
01-08-2023 - 31-07-2026
PAK UK Education Gateway Mobility Partnership for FacultyAlan Drew, Maria Crespo-Ribadeneyra, Annalisa Bruno, Devis Di Tommaso, Edo Boek, Mahdieh Sadabadi, Paul Balcombe and Christopher Jones
£26,500 British Council
01-04-2023 - 30-06-2024
Research Group
PhD Students
- Hassan Al Radhawi
Granular Imaging Analysis For Irregularly Shaped Particles Applied in Water Treatment Processes - Ulvi Amirjanov
Advanced Materials For Water Remediation - Bustos Jimenez
Enhanced Removal of Pfas From Water Resources Using Smart Materials, Advanced Filtration and Novel Foam Fractionation Methods - Saeid Faraji
Prevention of Phase-Separation of Corrosive Aqueous Acidic Solution Out of Liquid Carbon Dioxide - Yiwei Gao
Cultivation and Processing of Micro-Algae, in Space and on Earth, to Extract Proteins For Sustainable Food Applications - Jesus Gonzalez Espinosa
Improving The Quality of Drinking Water Using Liquid-Solid Fluidisation and Filtration Methods - Chenyang Song
A Comparative Study of Ammonia and Hydrogen Fuel Cells Using Life Cycle Assessment - Rose Walker
Kinetics of Reactions Between Impurities in Co2 Streams For Carbon Capture and Storage Operations
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