School of Chemistry and Chemical Engineering

  • 39 Stranmillis Road, David Keir Building

    BT9 5AG Belfast

    United Kingdom

Research Output 1981 2020

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Article
2018
8 Citations (Scopus)
101 Downloads (Pure)

Use of Batch Mixing To Investigate the Continuous Solvent-Free Mechanical Synthesis of OLED Materials by Twin-Screw Extrusion (TSE)

Crawford, D. E., James, S. L. & McNally, T., 02 Jan 2018, In : ACS Sustainable Chemistry & Engineering. 6, 1, p. 193–201 9 p.

Research output: Contribution to journalArticle

Open Access
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Organic light emitting diodes (OLED)
extrusion
Extrusion
acetate (salt)
metal
1 Citation (Scopus)
54 Downloads (Pure)
Open Access
File
Oxalic Acid
Oxalic acid
oxalic acid
Nitrates
Carbon
4 Citations (Scopus)
Biogas
Reforming reactions
Thermodynamics
thermodynamics
energy requirements
6 Citations (Scopus)

Utilization of NiO/porous ceramic monolithic catalyst for upgrading biomass fuel gas

Quan, C., Gao, N. & Wu, C., Jun 2018, In : Journal of the Energy Institute. 91, 3, p. 331-338 8 p.

Research output: Contribution to journalArticle

upgrading
Gas fuels
biomass
steam
Biomass
121 Downloads (Pure)

Vibration Ball Milling for the Synthesis of 5'-Thioadenosine 5'-Pyrophosphate (P'→5') Adenosine (dASppA)

Eguaogie, O. & Vyle, J. S., 13 Feb 2018, In : Current protocols in nucleic acid chemistry. 70, p. 1.41.1-1.41.12

Research output: Contribution to journalArticle

Open Access
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Ball milling
Vibration
Adenosine
Adenosine Diphosphate
Phosphites
3 Citations (Scopus)
109 Downloads (Pure)

Water-Tolerant Trifloaluminate Ionic Liquids: New and Unique Lewis Acidic Catalysts for the Synthesis of Chromane

Latos, P., Culkin, A., Barteczko, N., Boncel, S., Jurczyk, S., Brown, L., Nockemann, P., Chrobok, A. & Swadzba-Kwasny, M., 12 Nov 2018, In : Frontiers in Chemistry. 6, 15 p., 535.

Research output: Contribution to journalArticle

Open Access
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Ionic Liquids
Catalysts
Water
Lewis Acids
Carbon Nanotubes
11 Citations (Scopus)
40 Downloads (Pure)

“Sweet” Ionic Liquid Gels: Materials for Sweetening of Fuels

Gunaratne, H., Plechkova, N. & Seddon, K., 18 Jul 2018, In : Green Chemistry. p. 1-19

Research output: Contribution to journalArticle

Open Access
File
Ionic Liquids
Ionic liquids
Gels
gel
adsorption
2017
160 Downloads (Pure)

1‐(+)‐Dehydroabietylimidazolium Salts as Enantiomer Discriminators for NMR Spectroscopy

Gunaratne, H. Q. N., Laaksonen, T., Seddon, K. R. & Wähälä, K., 08 Mar 2017, In : Australian Journal of Chemistry. 70, 7

Research output: Contribution to journalArticle

Open Access
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Discriminators
Enantiomers
Nuclear magnetic resonance spectroscopy
Salts
Chirality
2 Citations (Scopus)

A Comparison of the Potential Capability of SFS, SPS and HVSFS for the Production of Photocatalytic Titania Coatings

Robinson, B., Tabecki, A., Paul, S., Shi, G., Mills, A., Parkin, I. P., Darr, J. A. & de Villiers Lovelock, H. L., Jan 2017, In : Journal of Thermal Spray Technology. 26, 1, p. 161-172

Research output: Contribution to journalArticle

Titania
sprayers
flames
Suspensions
Titanium
3 Citations (Scopus)
147 Downloads (Pure)

A continuum approach modeling of surface composition and ternary component distribution inside low fat milk emulsions during single droplet drying

Putranto, A., Foerster, M., Woo, M. W., Selomulya, C. & Chen, X. D., 06 Feb 2017, In : AIChE Journal. 11 p.

Research output: Contribution to journalArticle

Open Access
File
Oils and fats
Emulsions
Surface structure
Drying
Milk
16 Citations (Scopus)
117 Downloads (Pure)

Action Spectra in Semiconductor Photocatalysis

Lee, S-K., Mills, A. & O'Rourke, C., 30 Jun 2017, In : Chemical Society Reviews. 46, p. 4877-4984 8 p.

Research output: Contribution to journalArticle

Open Access
File
Photocatalysis
Photocatalysts
Coloring Agents
Semiconductor materials
Radiation
16 Citations (Scopus)
383 Downloads (Pure)
Open Access
File
Aluminum foil
Acids
Aluminum Oxide
Chlorine
Methane
8 Citations (Scopus)
181 Downloads (Pure)

A Fluctuation Equation of State for Prediction of High-Pressure Densities of Ionic Liquids

Chorazewski, M., Postnikov, E. B., Jasiok, B., Nedyalkov, Y. V. & Jacquemin, J., 17 Jul 2017, In : Scientific Reports. 9 p., 5563.

Research output: Contribution to journalArticle

Open Access
File
fluctuation theory
equations of state
liquids
predictions
compressibility
8 Citations (Scopus)
188 Downloads (Pure)

A Group Contribution Method for the Evaluation of the Volumetric Properties of Ionic Liquids Using the Experimental Data Recommended by Mathematical Gnostics

ZHAO, NAN., Menegolla, H. B., Degirmenci, V., Wagner, Z., Bendová, M. & Jacquemin, J., 23 May 2017, In : Industrial and Engineering Chemistry Research.

Research output: Contribution to journalArticle

Open Access
File
Ionic Liquids
Ionic liquids
Temperature
Binary mixtures
Density (specific gravity)
7 Citations (Scopus)
151 Downloads (Pure)
Open Access
File
Powders
Screening
Electrodes
Catalysts
Glassy carbon
1 Citation (Scopus)
135 Downloads (Pure)

An accurate account of mass loss during cheese ripening described using the reaction engineering approach (REA) - based model

Putranto, A., Woo, M. W., Selomulya, C. & Chen, X. D., 28 Dec 2017, In : International Journal of Food Science and Technology.

Research output: Contribution to journalArticle

Open Access
File
Cheeses
cheese ripening
Cheese
engineering
activation energy
4 Citations (Scopus)
194 Downloads (Pure)

A new model to predict diffusive self-heating during composting incorporating the reaction engineering approach (REA) framework

Putranto, A. & Chen, X. D., May 2017, In : Bioresource Technology. 232, p. 211-221 11 p.

Research output: Contribution to journalArticle

Open Access
File
Composting
composting
heating
Heating
engineering
6 Citations (Scopus)
173 Downloads (Pure)

An introduction to zwitterionic salts

Blesic, M., Gilmore, B. F., Holbrey, J. D., Jacquemin, J., Level, G., Nockemann, P. & Stella, L., 07 Sep 2017, In : Green Chemistry. 19, 17, p. 4007-4011 5 p.

Research output: Contribution to journalArticle

Open Access
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Hydrophilicity
Anions
Cations
Negative ions
Salts
2 Citations (Scopus)

A photocatalytic impeller reactor for gas phase heterogeneous photocatalysis

Tokode, O., Prabhu, R., Lawton, L. A. & Robertson, P., Aug 2017, In : Journal of Environmental Chemical Engineering. 5, 4, p. 3942-3948

Research output: Contribution to journalArticle

Catalyst deactivation
Photooxidation
Photocatalysis
Toluene
Reaction rates
2 Citations (Scopus)

Application of the reaction engineering approach (REA) for modeling of the convective drying of onion

Compaore, A., Dissa, A. O., Rogaume, Y., Putranto, A., Chen, X. D., Mangindaan, D., Zoulalian, A., Rémond, R. & Tiendrebeogo, E., 2017, In : Drying Technology. 35, 4, p. 500-508 9 p.

Research output: Contribution to journalArticle

drying
Drying
engineering
drying apparatus
Solar dryers
6 Citations (Scopus)
115 Downloads (Pure)

A rational catalyst design of CO oxidation usingthe bonding contribution equation

Hu, P. & Wang, Z., 24 May 2017, In : Chemical Communications. 4 p.

Research output: Contribution to journalArticle

Open Access
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Carbon Monoxide
Oxidation
Catalysts
Discrete Fourier transforms
Surface structure
13 Citations (Scopus)
121 Downloads (Pure)

Borenium ionic liquids as catalysts for Diels–Alder reaction: tuneable Lewis superacids for catalytic applications

Matuszek, K., Coffie, S., Chrobok, A. & Swadzba-Kwasny, M., 2017, In : CATALYSIS SCIENCE & TECHNOLOGY. 7, 5, p. 1045-1049

Research output: Contribution to journalArticle

Open Access
File
Ionic Liquids
Ionic liquids
Catalysts
Lewis Acids
Cations
5 Citations (Scopus)
127 Downloads (Pure)

Catalytic mechanism of Phenylacetone monooxygenases for non-native linear substrates: implications on rational engineering of BVMOs to expand the substrate specificity

Carvalho, A. T. P., Dourado, D. F. A. R., Skvortsov, T., de Abreu, M., Ferguson, L., Quinn, D. J., Moody, T. S. & Huang, M., 07 Sep 2017, In : Physical Chemistry Chemical Physics. 19, 39, p. 26851-26861 11 p.

Research output: Contribution to journalArticle

Open Access
File
Mixed Function Oxygenases
engineering
Substrates
Quantum theory
quantum mechanics
5 Citations (Scopus)

Cationic Palladium(II) Complexes for Catalytic Wacker-Type Oxidation of Styrenes to Ketones Using O2 as the Sole Oxidant

Chai, H., Cao, Q., Dornan, L. M., Hughes, N. L., Brown, C. L., Nockemann, P., Li, J. & Muldoon, M. J., 20 Dec 2017, In : European Journal of Inorganic Chemistry. 2017, 47, p. 5604-5608 5 p.

Research output: Contribution to journalArticle

Styrenes
Palladium
Ketones
Oxidants
Acetophenones
9 Citations (Scopus)
158 Downloads (Pure)

Chiral smectic-A and smectic-C phases with de Vries characteristics

Stevenson, P., 21 Jun 2017, In : Physical Review E. 95, 6, 9 p., 062704.

Research output: Contribution to journalArticle

Open Access
File
Tilt
Order Parameter
Angle
Infrared Spectroscopy
Cell
9 Citations (Scopus)
354 Downloads (Pure)

Circular Biogas-Based Economy in a Rural Agricultural Setting

Blades, L., Morgan, K., Douglas, R., Glover, S., De Rosa, M., Cromie, T. & Smyth, B., 01 Sep 2017, In : Energy Procedia. 123, p. 89-96 8 p.

Research output: Contribution to journalArticle

Open Access
File
Anaerobic digestion
Biogas
Dairies
Farms
Processing
6 Citations (Scopus)
141 Downloads (Pure)

Coating of Pd/C catalysts with Lewis-acidic ionic liquids and liquid coordination complexes–SCILL induced activity enhancement in arene hydrogenation

Lijewski, M., Hogg, J. M., Swadzba-Kwasny, M., Wasserscheid, P. & Haumann, M., 2017, In : RSC Advances. 7, 44, p. 27558-27563

Research output: Contribution to journalArticle

Open Access
File
Ionic Liquids
Ionic liquids
Hydrogenation
Coatings
Catalysts
13 Citations (Scopus)

Cobalt hydroxide nanoflakes and their application as supercapacitors and oxygen evolution catalysts

Rovetta, A., Browne, M., Harvey, A., Godwin, I., Coleman, J. & Lyons, M., 21 Aug 2017, In : Nanotechnology. 28, 37, p. 1-12 375401.

Research output: Contribution to journalArticle

Oxides
Cobalt
Oxygen
Catalysts
Nickel
11 Citations (Scopus)
95 Downloads (Pure)

Combined in Situ XAFS/DRIFTS Studies of the Evolution of Nanoparticle Structures from Molecular Precursors

Dann, E. K., Gibson, E. K., Catlow, R. A., Collier, P., Eralp Erden, T., Gianolio, D., Hardacre, C., Kroner, A., Raj, A., Goguet, A. & Wells, P. P., 12 Sep 2017, In : Chemistry of Materials. 29, 17, p. 7515-7523 9 p.

Research output: Contribution to journalArticle

Open Access
File
Nanoparticles
Ligands
X ray absorption fine structure spectroscopy
Methane
Precious metals
2 Citations (Scopus)
134 Downloads (Pure)

Communication: Inflection in the pressure dependent conductivity of the protic ionic liquid C8HIM NTf2

Thoms, E., Wojnarowska, Z., Goodrich, P., Jacquemin, J. & Paluch, M., 09 May 2017, In : Journal of Chemical Physics. 146, 18, 3 p., 181102.

Research output: Contribution to journalArticle

Open Access
File
Ionic Liquids
communication
conductivity
Structural relaxation
Communication
26 Citations (Scopus)
433 Downloads (Pure)

Comparative assessment of visible light and UV active photocatalysts by hydroxyl radical quantification

Nagarajan, S., Skillen, N. C., Fina, F., Zhang, G., Randhorn, C., Lawton, L. A., Irvine, J. T. S. & Robertson, P. K. J., 01 Feb 2017, In : Journal of Photochemistry and Photobiology A: Chemistry. 334, p. 13-19 7 p.

Research output: Contribution to journalArticle

Open Access
File
hydroxyl radicals
Photocatalysts
Hydroxyl Radical
7-hydroxycoumarin
ultraviolet radiation
3 Citations (Scopus)
67 Downloads (Pure)

Composition of catalyst resting states of hydroformylation catalysts derived from bulky mono-phosphorus ligands, rhodium dicarbonyl acetylacetonate and syngas

How, R. C., Dingwall, P., Hembre, R. T., Ponasik, J. A., Tolleson, G. S. & Clarke, M. L., Jun 2017, In : Molecular Catalysis. 434, p. 116-122 7 p.

Research output: Contribution to journalArticle

Open Access
File
Hydroformylation
Rhodium
synthesis gas
rhodium
Phosphorus
4 Citations (Scopus)

Conformational and Energy Evaluations of Novel Peptides Binding to Dengue Virus Envelope Protein

Amir-Hassan, A., Sanghiran Lee, V., Baharuddin, A., Othman, S., Xu, Y., Huang, M., Yusof, R., Rahman, N. A. & Othman, R., Jun 2017, In : Journal of Molecular Graphics and Modelling. 74, p. 273–287

Research output: Contribution to journalArticle

Viral Envelope Proteins
viruses
Viruses
Peptides
peptides
10 Citations (Scopus)
113 Downloads (Pure)

Consolidating Molecular Logic with New Solid-bound YES and PASS 1 Gates and their Combinations

McKinney, B. O. F., Daly, B., Yao, C., Shroeder, M. & de Silva, A. P., 27 Mar 2017, In : ChemPhysChem. 7 p.

Research output: Contribution to journalArticle

Open Access
File
Fluorophores
Polystyrenes
Silicon Dioxide
logic
Color
5 Citations (Scopus)
180 Downloads (Pure)

Continuous flow gas phase photoreforming of methanol at elevated reaction temperatures sensitised by Pt/TiO2

Caravaca, A., Daly, H., Smith, M., Mills, A., Chansai, S. & Hardacre, C., 31 Mar 2017, In : Reaction Chemistry & Engineering. 1, p. 649-657

Research output: Contribution to journalArticle

Open Access
File
Carbon Monoxide
Methanol
formic acid
Gases
Catalysts
16 Citations (Scopus)
114 Downloads (Pure)

Continuous multi-step synthesis by extrusion – telescoping solvent-free reactions for greater efficiency

Crawford, D. E., Miskimmin, C. K., Cahir, J. & James, S., 10 Nov 2017, In : Chemical Communications. 53, 97, p. 13067-13070 4 p.

Research output: Contribution to journalArticle

Open Access
File
Extrusion
3 Citations (Scopus)
139 Downloads (Pure)

Cross-validatory framework for optimal parameter estimation of KPCA and KPLS models

Fu, Y., Kruger, U., Li, Z., Xie, L., Thompson, J., Rooney, D., Hahn, J. & Yang, H., Aug 2017, In : Chemometrics and Intelligent Laboratory Systems. 167, p. 196-207 12 p.

Research output: Contribution to journalArticle

Open Access
File
Parameter estimation
Principal component analysis
5 Citations (Scopus)
92 Downloads (Pure)

Cyclometalation via Carbon–Fluorine Bond Activation Induced by Silver Particles

Thomas, H., Wang, Y., Lorenzini, F., Coles, S. J., Horton, P. N., Marr, A. C. & Saunders, G. C., 13 Mar 2017, In : Organometallics. 36, 5, p. 960-963 4 p.

Research output: Contribution to journalArticle

Open Access
File
Silver
Chemical activation
silver
activation
Methylene Chloride
4 Citations (Scopus)

Delayed release of a fragrance from novel ionic liquids

Ferrero Vallana, F. M., Holland, L. A. M., Seddon, K. R. & Todini, O., 2017, In : New journal of chemistry. 41, p. 1037 -1045 9 p.

Research output: Contribution to journalArticle

Fragrances
Ionic Liquids
Vapor pressure
Ionic liquids
Infrared spectroscopy
153 Downloads (Pure)

Deployment of Undeground Coal Gasification in India

Singan, A. & Ranade, V. V., 25 Jul 2017, In : Current Science.

Research output: Contribution to journalArticle

Open Access
File
Coal gasification
Synthesis gas
Coal
Steam
Coal gas
1 Citation (Scopus)
415 Downloads (Pure)

Deployment of underground coal gasification in India

Singan, A. & Ranade, V. V., 25 Jul 2017, In : Current Science. 113, 2, p. 218-227

Research output: Contribution to journalArticle

Open Access
File
gas
coal
oxidant
electricity
coal gasification
10 Citations (Scopus)
199 Downloads (Pure)
Open Access
File
Alkanesulfonates
Ionic Liquids
Ionic liquids
Fermentation
fermentation
13 Citations (Scopus)
193 Downloads (Pure)

Developing techno-economically sustainable methodologies for deep desulfurization using hydrodynamic cavitation

Suryawanshi, N. B., Bhandari, V. M., Sorokhaibam, L. G. & Ranade, V. V., 15 Dec 2017, In : Fuel. 210, p. 482-490

Research output: Contribution to journalArticle

Open Access
File
Desulfurization
Cavitation
Hydrodynamics
Vortex flow
Orifices
3 Citations (Scopus)
916 Downloads (Pure)

Drying of Almonds I: Single Particle

Chilka, A. G. & Ranade, V. V., 07 Jun 2017, In : Indian Chemical Enginer. p. 1-23

Research output: Contribution to journalArticle

Open Access
File
Drying
Mass transfer
Heat transfer
Flow patterns
Dynamic models
1 Citation (Scopus)
144 Downloads (Pure)

Drying of Almonds II: Multiple Particles

Chilka, A. G. & Ranade, V. V., 18 Aug 2017, In : Indian Chemical Enginer. 18 p.

Research output: Contribution to journalArticle

Open Access
File
Drying
Moisture
Heat transfer coefficients
Computational fluid dynamics
Mass transfer
3 Citations (Scopus)
261 Downloads (Pure)

Economic analysis of ultrasound-assisted oxidative desulfurization

Anderson, K., Atkins, M. P., Borges, P., Chan, Z. P., Rafeen, M. S., Sebran, N. H., van der Pool, E. & Vleeming, J. H., Jun 2017, In : Energy Sources. 12, 4, p. 305 - 311

Research output: Contribution to journalArticle

Open Access
File
Economic analysis
Desulfurization
Sulfur
Ultrasonics
Sulfur Compounds
6 Citations (Scopus)
199 Downloads (Pure)

Electrical Resistance Tomography for Gas Holdup in a Gas-Liquid Stirred Tank Reactor

Sardeshpande, M. V., Gupta, S. & Ranade, V. V., 18 Apr 2017, In : Chemical Engineering Science.

Research output: Contribution to journalArticle

Open Access
File
Acoustic impedance
Tomography
Gases
Liquids
Hydrogenation
30 Citations (Scopus)
205 Downloads (Pure)
Open Access
File
Cerium compounds
Methane
Zirconia
Catalyst activity
methane
4 Citations (Scopus)
94 Downloads (Pure)

Enzyme-Catalysed Synthesis of Cyclohex-2-en-1-one cis-Diols from Substituted Phenols, Anilines and Derived 4-Hydroxycyclohex-2-en-1-ones

Boyd, D. R., Sharma, N. D., McIntyre, P. B. A., Stevenson, P. J., McRoberts, W. C., Gohil, A., Hoering, P. & Allen, C., 23 Nov 2017, In : Advanced Synthesis and Catalysis. 359, 22, p. 4002-4014 13 p.

Research output: Contribution to journalArticle

Open Access
File
Aniline Compounds
Phenols
Metabolites
Phenol
Enzymes