Dr Edo Boek

Edo Boek
School of Engineering and Materials Science
Queen Mary University of London

Publications

Relevant PublicationPublications of specific relevance to the Centre for Sustainable Engineering

2024

bullet iconCollins IR, Floriano DC, Paevskiy I, Wee J, Boek ES and Mohammadi MK (2024). Transition from oil & gas drilling fluids to geothermal drilling fluids. Geoenergy Science and Engineering, Elsevier vol. 233 
01-02-2024

2023

bullet iconErfani H, Haghani R, McClure J, Boek E and Berg CF (2023). Spatial Characterization of Wetting in Porous Media Using Local Lattice-Boltzmann Simulations. Transport in Porous Media, Springer Nature, 1-20.  
24-12-2023
bullet iconHuang Y, Liang Y, Masuda Y, Cui W, Tsuji T, Matsuoka T, Boek ES and Takabayashi K (2023). Evaluation of Asphaltene Hildebrand and Hansen Solubility Parameters Using Digital Oil Models with Molecular Dynamics Simulation. Energy & Fuels, American Chemical Society (ACS) vol. 37 (19), 14699-14713.  
18-09-2023

2022

bullet iconCui W, Huo K, Sugiyama S, Liang Y, Masuda Y, Morimoto M, Matsuoka T, Boek ES, Kaito Y, Nakagawa K and Ito D (2022). Microstructural evolution of bitumen during the glass transition: An application of digital oil. Fuel, Elsevier vol. 335 
14-12-2022
bullet iconLuo Z, Burrows SA, Smoukov SK, Fan X and Boek ES (2022). Extension of the TraPPE Force Field for Battery Electrolyte Solvents. Journal of Physical Chemistry B (Soft Condensed Matter and Biophysical Chemistry), American Chemical Society 
03-10-2022
bullet iconKalhor Mohammadi M, Riahi S and Boek ES (2022). An insight review on formation damage induced by drilling fluids. Reviews in Chemical Engineering, De Gruyter 
26-01-2022

2021

bullet iconKalhor Mohammadi M, Riahi S and Boek ES (2021). Developing novel bio-nano catalyst well clean up fluid to remove formation damage induced by polymeric water-based drilling fluids. Journal of Petroleum Science and Engineering, Elsevier vol. 210 
02-12-2021
bullet iconGostick JT, Misaghian N, Yang J and Boek ES (2021). Simulating volume-controlled invasion of a non-wetting fluid in volumetric images using basic image processing tools. Computers and Geosciences, Elsevier vol. 158 
06-11-2021
bullet iconLuo Z, Burrows SA, Fan X, Smoukov SK and Boek ES (2021). Virtual voids method to generate low-density microporous carbon structures using quenched molecular dynamics simulation. Carbon vol. 183, 438-448.  
15-10-2021
bullet iconKramer OJI, van Schaik C, Dacomba-Torres PDR, de Moel PJ, Boek ES, Baars ET, Padding JT and van der Hoek JP (2021). Fluidisation characteristics of granular activated carbon in drinking water treatment applications. Advanced Powder Technology vol. 32 (9), 3174-3188.  
01-09-2021
bullet iconNijssen TMJ, Kramer OJI, de Moel PJ, Rahman J, Kroon JP, Berhanu P, Boek ES, Buist KA, van der Hoek JP, Padding JT and Kuipers JAM (2021). Experimental and numerical insights into heterogeneous liquid-solid behaviour in drinking water softening reactors. Chemical Engineering Science: X vol. 11 
01-08-2021
bullet iconGray F, Anabaraonye BU, Crawshaw JP and Boek ES (2021). Pore-scale dissolution mechanisms in calcite-CO2-brine systems: The impact of non-linear reaction kinetics and coupled ion transport. Geochimica et Cosmochimica Acta vol. 305, 323-338.  
15-07-2021
bullet iconKramer OJI, van Schaik C, Hangelbroek JJ, de Moel PJ, Colin MG, Amsing M, Boek ES, Breugem WP, Padding JT and van der Hoek JP (2021). A novel sensor measuring local voidage profile inside a fluidised bed reactor. Journal of Water Process Engineering 
02-06-2021
bullet iconKramer OJI, de Moel PJ, Padding JT, Baars ET, Rutten SB, Elarbab AHE, Hooft JFM, Boek ES and van der Hoek JP (2021). New hydraulic insights into rapid sand filter bed backwashing using the Carman–Kozeny model. Water Research, Elsevier vol. 197 
23-03-2021
bullet iconBurrows SA, Korotkin I, Smoukov SK, Boek E and Karabasov S (2021). Benchmarking of Molecular Dynamics Force Fields for Solid–Liquid and Solid–Solid Phase Transitions in Alkanes. The Journal of Physical Chemistry B, American Chemical Society (ACS) vol. 125 (19), 5145-5159.  
16-03-2021

2020

bullet iconZacharoudiou I, Boek ES and Crawshaw J (2020). Pore-Scale Modeling of Drainage Displacement Patterns in Association With Geological Sequestration of CO2. Water Resources Research vol. 56 (11) 
01-11-2020
bullet iconJiang F, Yang J, Boek E and Tsuji T (2020). Investigation of viscous coupling effects in three-phase flow by lattice Boltzmann direct simulation and machine learning technique. Advances in Water Resources, Elsevier vol. 147 
29-10-2020
bullet iconKramer OJI, de Moel PJ, Padding JT, Baars ET, Hasadi YMFE, Boek ES and van der Hoek JP (2020). Accurate voidage prediction in fluidisation systems for full-scale drinking water pellet softening reactors using data driven models. Journal of Water Process Engineering, Elsevier vol. 37 
01-07-2020
bullet iconKramer OJI, Padding JT, van Vugt WH, de Moel PJ, Baars ET, Boek ES and van der Hoek JP (2020). Improvement of voidage prediction in liquid-solid fluidized beds by inclusion of the Froude number in effective drag relations. International Journal of Multiphase Flow, Elsevier vol. 127 
01-06-2020

2019

bullet iconIwase M, Liang Y, Masuda Y, Morimoto M, Matsuoka T, Boek ES, Kaito Y and Nakagawa K (2019). Application of a Digital Oil Model to Solvent-Based Enhanced Oil Recovery of Heavy Crude Oil. Energy and Fuels, American Chemical Society 
17-10-2019
bullet iconLaw JC, Headen TF, Jiménez-Serratos G, Boek ES, Murgich J and Müller EA (2019). Catalogue of Plausible Molecular Models for the Molecular Dynamics of Asphaltenes and Resins Obtained from Quantitative Molecular Representation. Energy & Fuels, American Chemical Society (ACS) vol. 33 (10), 9779-9795.  
19-09-2019
bullet iconYang L, Yang J, Boek E, Sakai M and Pain C (2019). Image-based simulations of absolute permeability with massively parallel pseudo-compressible stabilised finite element solver. Computational Geosciences, Springer Science and Business Media LLC 
17-06-2019

2018

bullet iconZacharoudiou I, Boek ES and Crawshaw J (2018). The impact of drainage displacement patterns and Haines jumps on CO2 storage efficiency. Scientific Reports vol. 8 (1) 
01-12-2018
bullet iconGray F, Anabaraonye B, Shah S, Boek E and Crawshaw J (2018). Chemical mechanisms of dissolution of calcite by HCl in porous media: Simulations and experiment. Advances in Water Resources vol. 121, 369-387.  
01-11-2018
bullet iconSugiyama S, Liang Y, Murata S, Matsuoka T, Morimoto M, Ohata T, Nakano M and Boek ES (2018). Construction, validation, and application of digital oil: Investigation of asphaltene association toward asphaltene-precipitation prediction. SPE Journal vol. 23 (3), 952-968.  
01-06-2018
bullet iconSugiyama S, Liang Y, Murata S, Matsuoka T, Morimoto M, Ohata T, Nakano M and Boek ES (2018). Construction, Validation, and Application of Digital Oil: Investigation of Asphaltene Association Toward Asphaltene-Precipitation Prediction. Society of Petroleum Engineers Journal, Society of Petroleum Engineers (SPE) vol. 23 (03), 952-968.  
06-02-2018

2017

bullet iconIwase M, Sugiyama S, Liang Y, Masuda Y, Morimoto M, Matsuoka T, Boek ES, Ueda R and Nakagawa K (2017). Development of Digital Oil for Heavy Crude Oil: Molecular Model and Molecular Dynamics Simulations. Energy and Fuels vol. 32 (3), 2781-2792.  
22-12-2017
bullet iconLi X, Guo Y, Boek ES and Guo X (2017). Experimental Study on Kinetics of Asphaltene Aggregation in a Microcapillary. Energy and Fuels vol. 31 (9), 9006-9015.  
21-09-2017
bullet iconZacharoudiou I, Chapman EM, Boek ES and Crawshaw JP (2017). Pore-filling events in single junction micro-models with corresponding lattice Boltzmann simulations. Journal of Fluid Mechanics vol. 824, 550-573.  
06-07-2017
bullet iconBoek ES, Zacharoudiou I, Gray F, Shah SM, Crawshaw JP and Yang J (2017). Multiphase-flow and reactive-transport validation studies at the pore scale by use of lattice Boltzmann computer simulations. SPE ATCE
01-06-2017
bullet iconWelch NJ, Gray F, Butcher AR, Boek ES and Crawshaw JP (2017). High-Resolution 3D FIB-SEM Image Analysis and Validation of Numerical Simulations of Nanometre-Scale Porous Ceramic with Comparisons to Experimental Results. Transport in Porous Media, Springer Verlag vol. 118 (3), 373-392.  
04-05-2017
bullet iconShah SM, Crawshaw JP, Gray F, Yang J and Boek ES (2017). Convex hull approach for determining rock representative elementary volume for multiple petrophysical parameters using pore-scale imaging and Lattice–Boltzmann modelling. Advances in Water Resources, Elsevier vol. 104, 65-75.  
14-03-2017
bullet iconHeaden TF, Boek ES, Jackson G, Totton TS and Müller EA (2017). Simulation of Asphaltene Aggregation through Molecular Dynamics: Insights and Limitations. Energy and Fuels, American Chemical Society vol. 31 (2), 1108-1125.  
03-01-2017
bullet iconBoek ES (2017). Chapter 10 Progress in Computer Simulations of Wormlike Micellar Fluids. Wormlike Micelles  279-297.  
01-01-2017

2016

bullet iconSugiyama S, Liang Y, Murata S, Matsuoka T, Morimoto M, Ohata T, Nakano M and Boek ES (2016). Construction of Digital Oil for Investigation of Crude Oil Properties at Different Thermodynamic Conditions. Day 3 Wed, November 16, 2016
12-11-2016
bullet iconShah SM, Crawshaw JP and Boek ES (2016). Three-dimensional imaging of porous media using confocal laser scanning microscopy. Journal of Microscopy, Wiley vol. 265 (2), 261-271.  
25-10-2016
bullet iconGray F, Cen J and Boek ES (2016). Simulation of dissolution in porous media in three dimensions with lattice Boltzmann, finite-volume, and surface-rescaling methods. Phys Rev E vol. 94 (4-1), 043320-043320.  
25-10-2016
bullet iconHu R, Crawshaw JP, Trusler JPM and Boek ES (2016). Rheology and Phase Behavior of Carbon Dioxide and Crude Oil Mixtures. Energy and Fuels, American Chemical Society vol. 31 (6), 5776-5784.  
22-09-2016
bullet iconShah SM, Gray F, Crawshaw JP and Boek ES (2016). Micro-computed tomography pore-scale study of flow in porous media: Effect of voxel resolution. Advances in Water Resources vol. 95, 276-287.  
01-09-2016
bullet iconGray F, Cen J, Shah SM, Crawshaw JP and Boek ES (2016). Simulating dispersion in porous media and the influence of segmentation on stagnancy in carbonates. Advances in Water Resources, Elsevier vol. 97, 1-10.  
25-08-2016
bullet iconZhou J, Lu X and Boek ES (2016). Changes in the interlayer structure and thermodynamics of hydrated montmorillonite under basin conditions: Molecular simulation approaches. Clays and Clay Minerals, Clay Minerals Society vol. 64 (4), 503-511.  
01-08-2016
bullet iconRoss DA and Boek ES (2016). Molecular Dynamics Simulations of Slip on Curved Surfaces. Oil & Gas Science and Technology – Revue d’IFP Energies nouvelles, EDP Sciences vol. 71 (4) 
23-06-2016
bullet iconZacharoudiou I and Boek ES (2016). Capillary filling and Haines jump dynamics using free energy Lattice Boltzmann simulations. Advances in Water Resources vol. 92, 43-56.  
01-04-2016
bullet iconZhou J, Lu X and Boek ES (2016). Confined water in tunnel nanopores of sepiolite: Insights from molecular simulations. American Mineralogist, Mineralogical Society of America vol. 101 (3), 713-718.  
01-03-2016
bullet iconGray F and Boek E (2016). Enhancing Computational Precision for Lattice Boltzmann Schemes in Porous Media Flows. Computation, MDPI vol. 4 (1) 
17-02-2016
bullet iconAlvim RS, Lima FCDA, Sánchez VM, Headen TF, Boek ES and Miranda CR (2016). Adsorption of asphaltenes on the calcite (10.4) surface by first-principles calculations. RSC Advances, Royal Society of Chemistry (RSC) vol. 6 (97), 95328-95336.  
01-01-2016

2015

bullet iconZhou J, Boek ES, Zhu J, Lu X, Sprik M and He H (2015). Molecular Simulation Study of Hydrated Na-Rectorite. Langmuir, American Chemical Society (ACS) vol. 31 (6), 2008-2013.  
04-02-2015

2014

bullet iconHibi R, Tagami K, Kobayashi K, Liang Y, Honda H, Murata S, Matsuoka T, Morimoto M, Uetani T and Boek ES (2014). Investigation of Asphaltene-Asphaltene Association and Aggregation for Compositional Reservoir Simulators By Quantitative Molecular Representations. All Days
10-12-2014
bullet iconHu R, Crawshaw JP, Trusler JPM and Boek ES (2014). Rheology of Diluted Heavy Crude Oil Saturated with Carbon Dioxide. Energy & Fuels, American Chemical Society (ACS) vol. 29 (5), 2785-2789.  
17-11-2014
bullet iconShah SM, Crawshaw JP and Boek ES (2014). Preparation of microporous rock samples for confocal laser scanning microscopy. Petroleum Geoscience, Geological Society of London vol. 20 (4), 369-374.  
28-10-2014
bullet iconBoek ES, Zacharoudiou I, Gray F, Shah SM, Crawshaw JP and Yang J (2014). Multiphase Flow and Reactive Transport at the Pore Scale Using Lattice-Boltzmann Computer Simulations. All Days
27-10-2014
bullet iconBoek ES (2014). Molecular dynamics simulations of interlayer structure and mobility in hydrated Li-, Na- and K-montmorillonite clays. Molecular Physics, Taylor & Francis vol. 112 (9-10), 1472-1483.  
13-05-2014

2013

bullet iconCrawshaw JP and Boek ES (2013). 12. Multi-scale Imaging and Simulation of Structure, Flow and Reactive Transport for C02 Storage and EOR in Carbonate Reservoirs. Geochemistry of Geologic CO2 Sequestration  431-458.  
31-12-2013
bullet iconYang J, Crawshaw J and Boek ES (2013). Quantitative determination of molecular propagator distributions for solute transport in homogeneous and heterogeneous porous media using lattice Boltzmann simulations. Water Resources Research, American Geophysical Union (AGU) vol. 49 (12), 8531-8538.  
01-12-2013
bullet iconShah SM, Yang J, Crawshaw JP, Gharbi O and Boek ES (2013). Predicting Porosity and Permeability of Carbonate Rocks From Core-Scale to Pore-Scale Using Medical CT, Confocal Laser Scanning Microscopy and Micro CT. Day 3 Wed, October 02, 2013
30-09-2013
bullet iconSeifried CM, Al Lawati S, Crawshaw JP and Boek ES (2013). Asphaltene Deposition in Capillary Flow. Day 3 Wed, October 02, 2013
30-09-2013
bullet iconLi X, Ross DA, Trusler JPM, Maitland GC and Boek ES (2013). Molecular Dynamics Simulations of CO2 and Brine Interfacial Tension at High Temperatures and Pressures. The Journal of Physical Chemistry B, American Chemical Society (ACS) vol. 117 (18), 5647-5652.  
30-04-2013
bullet iconYang J and Boek ES (2013). A comparison study of multi-component Lattice Boltzmann models for flow in porous media applications. 
01-03-2013
bullet iconSeifried CM, Crawshaw J and Boek ES (2013). Kinetics of Asphaltene Aggregation in Crude Oil Studied by Confocal Laser-Scanning Microscopy. 
20-02-2013
bullet iconMikami Y, Liang Y, Matsuoka T and Boek ES (2013). Molecular Dynamics Simulations of Asphaltenes at the Oil–Water Interface: From Nanoaggregation to Thin-Film Formation. 
16-01-2013
bullet iconCrawshaw JP and Boek ES (2013). Multi-scale Imaging and Simulation of Structure, Flow and Reactive Transport for CO2 Storage and EOR in Carbonate Reservoirs. Reviews in Mineralogy and Geochemistry, Mineralogical Society of America vol. 77 (1), 431-458.  
01-01-2013
bullet iconChapman EM, Yang J, Crawshaw JP and Boek ES (2013). Pore Scale Models for Imbibition of CO2 Analogue Fluids in Etched Micro-model||junctions Using Micro-fluidic Experiments and Direct Flow Calculations. 
01-01-2013
bullet iconGharbi O, Bijeljic B, Boek E and Blunt MJ (2013). Changes in Pore Structure and Connectivity Induced by CO2 Injection in Carbonates: A Combined Pore-Scale Approach. 
01-01-2013

2012

bullet iconStukan MR, Ligneul P and Boek ES (2012). Molecular Dynamics Simulation of Spontaneous Imbibition in Nanopores and Recovery of Asphaltenic Crude Oils Using Surfactants for EOR Applications. Oil & Gas Science and Technology – Revue d’IFP Energies nouvelles, EDP Sciences vol. 67 (5), 737-742.  
01-09-2012
bullet iconSuter JL, Sprik M and Boek ES (2012). Free energies of absorption of alkali ions onto beidellite and montmorillonite surfaces from constrained molecular dynamics simulations. Geochimica et Cosmochimica Acta, Elsevier vol. 91, 109-119.  
01-08-2012
bullet iconHalwachi HKA, Yakovlev DS and Boek ES (2012). Systematic Optimization of Asphaltene Molecular Structure and Molecular Weight Using the Quantitative Molecular Representation Approach. Energy & Fuels, American Chemical Society (ACS) vol. 26 (10), 6177-6185.  
01-08-2012
bullet iconLawal KA, Crawshaw JP, Boek ES and Vesovic V (2012). Experimental Investigation of Asphaltene Deposition in Capillary Flow. Energy & Fuels, American Chemical Society (ACS) vol. 26 (4), 2145-2153.  
11-04-2012
bullet iconLi X, Boek ES, Maitland GC and Trusler JPM (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–1. Journal of Chemical & Engineering Data, American Chemical Society (ACS) vol. 57 (5), 1369-1375.  
06-04-2012
bullet iconBoek ES (2012). 12th International Conference on Petroleum Phase Behavior and Fouling. Energy & Fuels, American Chemical Society (ACS) vol. 26 (5), 2547-2547.  
28-03-2012
bullet iconSengupta A, Hammond PS, Frenkel D and Boek ES (2012). Error analysis and correction for Lattice Boltzmann simulated flow conductance in capillaries of different shapes and alignments. Journal of Computational Physics, Elsevier vol. 231 (6), 2634-2640.  
01-03-2012
bullet iconLi X, Boek E, Maitland GC and Trusler JPM (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–1. Journal of Chemical & Engineering Data, American Chemical Society (ACS) vol. 57 (4), 1078-1088.  
01-03-2012

2011

bullet iconBoek ES, Stukan MR and Ligneul P (2011). Molecular dynamics simulation of surfactant flooding in asphaltenic oils for EOR applications. 
01-12-2011
bullet iconXu X, Crawshaw JP and Boek E (2011). Precipitation of asphaltene from crude oil using filtration experiments. 
01-12-2011
bullet iconLawal KA, Vesovic V and Boek ES (2011). Modeling Permeability Impairment in Porous Media due to Asphaltene Deposition under Dynamic Conditions. Energy & Fuels, American Chemical Society (ACS) vol. 25 (12), 5647-5659.  
23-11-2011
bullet iconBoek E, Fadili A, Williams MJ and Padding J (2011). Prediction of Asphaltene Deposition in Porous Media by Systematic Upscaling from a Colloidal Pore Scale Model to a Deep Bed Filtration Model. All Days
30-10-2011
bullet iconBoek ES, Hall C and Tardy PMJ (2011). Deep Bed Filtration Modelling of Formation Damage Due to Particulate Invasion from Drilling Fluids. Transport in Porous Media, Springer Nature vol. 91 (2), 479-508.  
28-09-2011

2010

bullet iconHeaden TF and Boek ES (2010). Potential of Mean Force Calculation from Molecular Dynamics Simulation of Asphaltene Molecules on a Calcite Surface. 
13-12-2010
bullet iconHeaden TF and Boek ES (2010). Molecular Dynamics Simulations of Asphaltene Aggregation in Supercritical Carbon Dioxide with and without Limonene. 
07-12-2010
bullet iconBoek E (2010). Pore Scale Simulation of Flow in Porous Media Using Lattice-Boltzmann Computer Simulations. All Days
19-09-2010
bullet iconStukan MR, Ligneul P, Crawshaw JP and Boek ES (2010). Spontaneous Imbibition in Nanopores of Different Roughness and Wettability. Langmuir, American Chemical Society (ACS) vol. 26 (16), 13342-13352.  
23-07-2010
bullet iconBoek ES and Venturoli M (2010). Lattice-Boltzmann studies of fluid flow in porous media with realistic rock geometries. Computers & Mathematics with Applications, Elsevier vol. 59 (7), 2305-2314.  
01-04-2010
bullet iconBoek ES, Headen TF and Padding JT (2010). Multi-scale simulation of asphaltene aggregation and deposition in capillary flow. Faraday Discussions, Royal Society of Chemistry (RSC) vol. 144, 271-284.  
01-01-2010

2009

bullet iconBoek ES, Wilson AD, Padding JT, Headen TF and Crawshaw JP (2009). Multi-scale Simulation and Experimental Studies of Asphaltene Aggregation and Deposition in Capillary Flow. 
21-12-2009
bullet iconWilson AD, Boek ES, Ladva HK, Crawshaw J and Padding JT (2009). Recent Developments in the Deposition of Colloidal Asphaltene in Capillary Flow: Experiments and Mesoscopic Simulation. All Days
27-05-2009
bullet iconBoek ES, Yakovlev DS and Headen TF (2009). Quantitative Molecular Representation of Asphaltenes and Molecular Dynamics Simulation of Their Aggregation. 
17-02-2009
bullet iconHeaden TF, Boek ES and Skipper NT (2009). Evidence for Asphaltene Nanoaggregation in Toluene and Heptane from Molecular Dynamics Simulations. 
02-02-2009
bullet iconPadding JT, Briels WJ, Stukan MR and Boek ES (2009). Review of multi-scale particulate simulation of the rheology of wormlike micellar fluids. Soft Matter, Royal Society of Chemistry (RSC) vol. 5 (22), 4367-4375.  
01-01-2009

2008

bullet iconHeaden TF, Boek ES, Stellbrink J and Scheven UM (2008). Small Angle Neutron Scattering (SANS and V-SANS) Study of Asphaltene Aggregates in Crude Oil. Langmuir, American Chemical Society (ACS) vol. 25 (1), 422-428.  
08-12-2008
bullet iconSuter JL, Boek ES and Sprik M (2008). Adsorption of a Sodium Ion on a Smectite Clay from Constrained Ab Initio Molecular Dynamics Simulations. The Journal of Physical Chemistry C, American Chemical Society (ACS) vol. 112 (48), 18832-18839.  
07-11-2008
bullet iconPadding JT, Boek ES and Briels WJ (2008). Dynamics and rheology of wormlike micelles emerging from particulate computer simulations. The Journal of Chemical Physics, AIP Publishing vol. 129 (7) 
18-08-2008
bullet iconBoek ES, Ladva HK, Crawshaw JP and Padding JT (2008). Colloidal Asphaltene Deposition and Aggregation in Capillary Flow: Experiments and Mesoscopic Simulation. 
07-07-2008
bullet iconStukan MR, Boek ES, Padding JT and Crawshaw JP (2008). Influence of system size and solvent flow on the distribution of wormlike micelles in a contraction-expansion geometry. The European Physical Journal E, Springer Nature vol. 26 (1-2) 
22-04-2008
bullet iconBoek ES, Ladva HK, Crawshaw JP and Padding JT (2008). Deposition of Colloidal Asphaltene in Capillary Flow: Experiments and Mesoscopic Simulation. Energy & Fuels, American Chemical Society (ACS) vol. 22 (2), 805-813.  
01-03-2008
bullet iconStukan MR, Boek ES, Padding JT, Briels WJ and Crawshaw JP (2008). Flow of wormlike micelles in an expansion-contraction geometry. Soft Matter, Royal Society of Chemistry (RSC) vol. 4 (4), 870-879.  
01-01-2008

2007

bullet iconBoek ES, Padding JT, Anderson VJ, Briels WJ and Crawshaw JP (2007). Flow of entangled wormlike micellar fluids: Mesoscopic simulations, rheology and μ-PIV experiments. Journal of Non-Newtonian Fluid Mechanics, Elsevier vol. 146 (1-3), 11-21.  
01-10-2007
bullet iconYakovlev DS and Boek ES (2007). Molecular Dynamics Simulations of Mixed Cationic/Anionic Wormlike Micelles. Langmuir, American Chemical Society (ACS) vol. 23 (12), 6588-6597.  
04-05-2007

2006

bullet iconVenturoli M and Boek ES (2006). Two-dimensional lattice-Boltzmann simulations of single phase flow in a pseudo two-dimensional micromodel. Physica A Statistical Mechanics and its Applications, Elsevier vol. 362 (1), 23-29.  
01-03-2006
bullet iconBoek ES and Padding JT (2006). CECAM Workshop on “Structure and Rheology of Self-Assembling and Aggregating Colloidal Suspensions: Theory, Simulation and Experiment”. 
01-02-2006
bullet iconTambach TJ, Boek ES and Smit B (2006). Molecular order and disorder of surfactants in clay nanocomposites. Physical Chemistry Chemical Physics, Royal Society of Chemistry (RSC) vol. 8 (23), 2700-2702.  
01-01-2006

2005

bullet iconPadding JT, Boek ES and Briels WJ (2005). Rheology of wormlike micellar fluids from Brownian and molecular dynamics simulations. Journal of Physics Condensed Matter, IOP Publishing vol. 17 (45) 
28-10-2005
bullet iconBoek ES, Padding JT, Otter WKD and Briels WJ (2005). Mechanical Properties of Surfactant Bilayer Membranes from Atomistic and Coarse-Grained Molecular Dynamics Simulations. The Journal of Physical Chemistry B, American Chemical Society (ACS) vol. 109 (42), 19851-19858.  
29-09-2005
bullet iconBoek ES, Padding JT, Anderson VJ, Tardy PMJ, Crawshaw JP and Pearson JRA (2005). Constitutive equations for extensional flow of wormlike micelles: stability analysis of the Bautista–Manero model. Journal of Non-Newtonian Fluid Mechanics, Elsevier vol. 126 (1), 39-46.  
01-02-2005

2004

bullet iconPadding JT and Boek ES (2004). Influence of shear flow on the formation of rings in wormlike micelles: A nonequilibrium molecular dynamics study. Physical Review E, American Physical Society (APS) vol. 70 (3) 
01-09-2004
bullet iconBoek ES, Otter WKD, Briels WJ and Iakovlev D (2004). Moleculardynamics simulation of amphiphilic bilayer membranes and wormlike micelles: a multiscale modelling approach to the design of viscoelastic surfactant solutions. Philosophical Transactions of the Royal Society A Mathematical Physical and Engineering Sciences, The Royal Society vol. 362 (1821), 1625-1638.  
02-06-2004
bullet iconGrosfils P, Boon JP, Chin J and Boek ES (2004). Structural and dynamical characterization of HeleShaw viscous fingering. Philosophical Transactions of the Royal Society A Mathematical Physical and Engineering Sciences, The Royal Society vol. 362 (1821), 1723-1734.  
02-06-2004
bullet iconPadding JT and Boek ES (2004). Evidence for diffusion-controlled recombination kinetics in model wormlike micelles. EPL (Europhysics Letters), IOP Publishing vol. 66 (5), 756-762.  
01-06-2004

2003

bullet iconBoek ES and Sprik M (2003). Ab Initio Molecular Dynamics Study of the Hydration of a Sodium Smectite Clay. The Journal of Physical Chemistry B, American Chemical Society (ACS) vol. 107 (14), 3251-3256.  
19-03-2003
bullet iconBoek ES, Chin J and Coveney PV (2003). Lattice Boltzmann simulation of the flow of non-Newtonian fluids in porous media. 
20-01-2003
bullet iconBOEK ES, CHIN J and COVENEY PV (2003). LATTICE BOLTZMANN SIMULATION OF THE FLOW OF NON-NEWTONIAN FLUIDS IN POROUS MEDIA. 
20-01-2003
bullet iconYakovlev D and Boek ES (2003). Structure of Bilayer Membranes of Gemini Surfactants with Rigid and Flexible Spacers from MD Simulations. 
01-01-2003

2002

bullet iconBoek ES, Jusufi A, Löwen H and Maitland GC (2002). Molecular design of responsive fluids: molecular dynamics studies of viscoelastic surfactant solutions. Journal of Physics Condensed Matter, IOP Publishing vol. 14 (40) 
26-09-2002
bullet iconChin J, Boek ES and Coveney PV (2002). Lattice Boltzmann simulation of the flow of binary immiscible fluids with different viscosities using the Shan-Chen microscopic interaction model. Philosophical Transactions of the Royal Society A Mathematical Physical and Engineering Sciences, The Royal Society vol. 360 (1792), 547-558.  
15-03-2002
bullet iconSprik M and Boek ES (2002). Ab initio molecular dynamics study of a model swelling smectite clay. 
01-01-2002
bullet iconCoveney PV, Griffin JLW, WATKINSON M, Whiting A and Boek ES (2002). Novel non-exfoliated clay-nanocomposite materials by in situ co-polymerisation of intercalated monomers: A combinatorial discovery approach. Mol. Sim. vol. 28 (3), 295-316.  
01-01-2002

2001

bullet iconvan der Kooij FM, Boek ES and Philipse AP (2001). Rheology of Dilute Suspensions of Hard Platelike Colloids. Journal of Colloid and Interface Science, Elsevier vol. 235 (2), 344-349.  
01-03-2001
bullet iconBains AS, Boek ES, Coveney PV, Williams SJ and Akbar MV (2001). Molecular Modelling of The Mechanism of Action of Organic Clay-Swelling Inhibitors. Molecular Simulation, Taylor & Francis vol. 26 (2), 101-145.  
01-02-2001

2000

bullet iconBailey L, Boek ES, Jacques SDM, Boassen T, Selle OM, Argillier J-F and Longeron DG (2000). Particulate Invasion From Drilling Fluids. Society of Petroleum Engineers Journal, Society of Petroleum Engineers (SPE) vol. 5 (04), 412-419.  
01-12-2000
bullet iconCoveney PV, de Silva H, Gomtsyan A, Whiting A and Boek ES (2000). Novel Approaches to Cross-linking High Molecular Weight Polysaccharides: Application to Guar-based Hydraulic Fracturing Fluids. Molecular Simulation, Taylor & Francis vol. 25 (5), 265-299.  
01-10-2000
bullet iconKutter S, Hansen J-P, Sprik M and Boek E (2000). Structure and phase behavior of a model clay dispersion: A molecular-dynamics investigation. The Journal of Chemical Physics, AIP Publishing vol. 112 (1), 311-322.  
01-01-2000

1999

bullet iconGrimbergen RFP, Boek ES, Meekes H and Bennema P (1999). Explanation for the supersaturation dependence of the morphology of lysozyme crystals. Journal of Crystal Growth, Elsevier vol. 207 (1-2), 112-121.  
01-11-1999
bullet iconBailey L, Boek E, Jacques S, Boassen T, Selle O, Argillier JF and Longeron D (1999). Particulate invasion from drilling fluids. SPE - European Formation Damage Control Conference, Proceedings, 471-480.  
01-01-1999

1998

bullet iconBoek ES and Van Der Schoot P (1998). Resolution Effects in Dissipative Particle Dynamics Simulations. International Journal of Modern Physics C, World Scientific Publishing vol. 9 (08), 1307-1318.  
01-12-1998
bullet iconDe Siqueira AVC, Skipper NT, Coveney PV and Boek ES (1998). Computer simulation evidence for enthalpy driven dehydration of smectite clays at elevated pressures and temperatures. Molecular Physics, Taylor & Francis vol. 95 (1), 123-123.  
01-09-1998

1997

bullet iconDE SIQUEIRA AVC and BOEK NTSPVCAES (1997). Computer simulation evidence for enthalpy driven dehydration of smectite clays at elevated pressures and temperatures. Molecular Physics, Taylor & Francis vol. 92 (1), 1-6.  
01-09-1997
bullet iconBoek ES, Coveney PV, Lekkerkerker HNW and van der Schoot P (1997). Simulating the rheology of dense colloidal suspensions using dissipative particle dynamics. Physical Review E, American Physical Society (APS) vol. 55 (3), 3124-3133.  
01-03-1997
bullet iconBoek ES, Coveney PV, Lekkerkerker HNW and vanderSchoot P (1997). Simulating the rheology of dense colloidal suspensions using dissipative particle dynamics. PHYSICAL REVIEW E vol. 55 (3), 3124-3133.  
01-01-1997

1996

bullet iconBoek ES, Coveney PV and Lekkerkerker HNW (1996). Computer simulation of rheological phenomena in dense colloidal suspensions with dissipative particle dynamics. Journal of Physics Condensed Matter, IOP Publishing vol. 8 (47) 
18-11-1996
bullet iconBoek ES, Coveney PV, Williams SJ and Bains AS (1996). A Robust Water Potential Parameterisation. Molecular Simulation, Taylor & Francis vol. 18 (3), 145-154.  
01-10-1996

1995

bullet iconBoek ES, Coveney PV and Skipper NT (1995). Molecular Modeling of Clay Hydration: A Study of Hysteresis Loops in the Swelling Curves of Sodium Montmorillonites. Langmuir, American Chemical Society (ACS) vol. 11 (12), 4629-4631.  
01-12-1995
bullet iconBoek ES, Coveney PV and Skipper NT (1995). Monte Carlo Molecular Modeling Studies of Hydrated Li-, Na-, and K-Smectites: Understanding the Role of Potassium as a Clay Swelling Inhibitor. Journal of the American Chemical Society, American Chemical Society (ACS) vol. 117 (50), 12608-12617.  
01-12-1995
bullet iconLiu XY, Boek ES, Briels WJ and Bennema P (1995). Analysis of morphology of crystals based on identification of interfacial structure. The Journal of Chemical Physics, AIP Publishing vol. 103 (9), 3747-3754.  
01-09-1995
bullet iconLiu XY, Boek ES, Briels WJ and Bennema P (1995). Prediction of crystal growth morphology based on structural analysis of the solid–fluid interface. Nature, Springer Nature vol. 374 (6520), 342-345.  
01-03-1995

1994

bullet iconBoek ES, Briels WJ and Feil D (1994). Interfaces between a Saturated Aqueous Urea Solution and Crystalline Urea: A Molecular Dynamics Study. The Journal of Physical Chemistry, American Chemical Society (ACS) vol. 98 (6), 1674-1681.  
01-02-1994

1993

bullet iconBoek ES and Briels WJ (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 ). The Journal of Chemical Physics, AIP Publishing vol. 98 (2), 1422-1427.  
15-01-1993

1992

bullet iconBoek ES, Briels WJ, van Eerden J and Feil D (1992). Molecular-dynamics simulations of interfaces between water and crystalline urea. The Journal of Chemical Physics, AIP Publishing vol. 96 (9), 7010-7018.  
01-05-1992

1991

bullet iconBoek ES, Feil D, Briels WJ and Bennema P (1991). From wave function to crystal morphology: application to urea and alpha-glycine. Journal of Crystal Growth, Elsevier vol. 114 (3), 389-410.  
01-11-1991

1989

bullet iconKrämer M, Blank B, Boek E, Ditzel E, Kankeleit E, Klotz-Engmann G, Müntz C, Oeschler H, Rhein M and Senger P (1989). δ-electron spectroscopy, a tool to study the dynamics of heavy-ion collisions. Physical Review C, American Physical Society (APS) vol. 40 (4), 1662-1676.  
01-10-1989

1986

bullet iconKrieg R, Boek E, Gollerthan U, Kankeleit E, Klotz-Engmann G, Krämer M, Meyer U, Oeschler H and Senger P (1986). Reaction dynamics studied via positron and electron spectroscopy. Physical Review C, American Physical Society (APS) vol. 34 (2), 562-575.  
01-08-1986

1985

bullet iconHaas B, Duchêne G, Beck FA, Byrski T, Gehringer C, Merdinger JC, Nourredine A, Rauch V, Vivien JP, Barrette J, Tobbeche S, Bożek E, Styczen J, Keinonen J, Dudek J and Nazarewicz W (1985). Strong Angular Momentum Effects in Near-Barrier Fusion Reactions. Physical Review Letters, American Physical Society (APS) vol. 54 (5), 398-401.  
04-02-1985

1975

bullet iconBożek E, Hrynkiewicz AZ, Merdinger JC and Vivien JP (1975). Hyperfine interactions of light nuclei recoil-implanted into iron. Physical Review C, American Physical Society (APS) vol. 12 (6), 1873-1877.  
01-12-1975

1967

bullet iconLiu XY, Boek ES, Briels WJ and Bennema P (1967). Analysis of morphology of crystals based on identification of interfacial structure. Physics of Fluids vol. 10 (11), 3747-3754.  
01-12-1967

Grants of specific relevance to the Centre for Sustainable Engineering

solid heart iconGrants of specific relevance to the Centre for Sustainable Engineering
bullet iconUtilisation of Synthetic Fuels for “Difficult-to-Decarbonise” Propulsion
Xi Jiang, Nader Karimi and Edo Boek
£436,930 EPSRC Engineering and Physical Sciences Research Council (01-08-2023 - 31-07-2026)
bullet iconPAK UK Education Gateway Mobility Partnership for Faculty
Alan 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)