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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2001
72 Citations (Scopus)

Crystal and liquid crystalline polymorphism in 1-alkyl-3-methylimidazolium tetrachloropalladate(II) salts

Hardacre, C., Holbrey, J., McCormac, P. B., McMath, S. E. J., Nieuwenhuyzen, M. & Seddon, K., 2001, In : Journal of Materials Chemistry. 11, 2, p. 346-350 5 p.

Research output: Contribution to journalArticle

Liquid Crystals
polymorphism
Polymorphism
Salts
Crystalline materials
61 Citations (Scopus)

Differences in the reactivity of organo-nitro and nitrito compounds over Al2O3-based catalysts active for the selective reduction of NOx

Zuzaniuk, V., Meunier, F. & Ross, J. R. H., 2001, In : Journal of Catalysis. 202(2), 2, p. 340 1 p.

Research output: Contribution to journalArticle

30 Citations (Scopus)

Dioxygenase-catalysed mono-, di- and tri-oxygenation of dialkyl sulfides and thioacetals: chemoenzymatic synthesis of enantiopure cis-diol sulfoxides

Boyd, D., Sharma, N., Haughey, S. A., Malone, J., King, A. W. T., McMurray, B. T., Alves-Areias, A., Allen, C., Holt, R. & Dalton, H., 2001, In : Journal of the Chemical Society - Perkin Transactions 1. 1, 24, p. 3288-3296 9 p.

Research output: Contribution to journalArticle

Sulfoxides
Dioxygenases
sulfoxide
Oxygenation
Sulfides
39 Citations (Scopus)

Disposable, stable media for reproducible surface-enhanced Raman spectroscopy

Bell, S. & Spence, S. J., 2001, In : Analyst. 126, 1, p. 1-3 3 p.

Research output: Contribution to journalArticle

Raman Spectrum Analysis
Raman spectroscopy
Polymethyl Methacrylate
Polymers
Sols
16 Citations (Scopus)

Estimating WTP for Speed Reduction from Dichotomous-Choice CV Responses with Follow-up: The Case of Rural Trunk Roads

Scarpa, R., Willis, K. G. & Garrod, G. D., 01 Dec 2001, In : Environmental and Resource Economics. 20, 4, p. 281-304 24 p.

Research output: Contribution to journalArticle

7 Citations (Scopus)
11 Citations (Scopus)

Gas-phase photocatalytic oxidation of dichlorobutenes

Hamill, N. A., Hardacre, C., Barth, J. A. C., Kalin, B. & Cunningham, J. F., 01 May 2001, In : Environmental Science and Technology. 35 (13), 13, p. 2823-2827 5 p.

Research output: Contribution to journalArticle

Carbon
Gases
oxidation
Oxidation
carbon
176 Citations (Scopus)

General trends in CO dissociation on transition metal surfaces

Liu, Z-P. & Hu, P., 15 May 2001, In : Journal of Chemical Physics. 114, 19, p. 8244-8247 4 p.

Research output: Contribution to journalArticle

Carbon Monoxide
metal surfaces
Transition metals
transition metals
dissociation
118 Citations (Scopus)

General trends in the barriers of catalytic reactions on transition metal surfaces

Liu, Z. P. & Hu, P., 15 Sep 2001, In : Journal of Chemical Physics. 115, 11, p. 4977-4980 4 p.

Research output: Contribution to journalArticle

metal surfaces
Transition metals
transition metals
trends
Potential energy surfaces
52 Citations (Scopus)

Hydrogen abstraction from ionic liquids by benzophenone triplet excited states

Muldoon, M., McLean, A. J., Gordon, C. M. & Dunkin, I. R., 21 Nov 2001, In : Chemical Communications. 1, 22, p. 2364-2365 2 p.

Research output: Contribution to journalArticle

Ionic Liquids
Ionic liquids
Excited states
Hydrogen
Activation energy
46 Citations (Scopus)

Hydrogenation of S to H2S on Pt(111): A first-principles study

Michaelides, A. & Hu, P., 08 Nov 2001, In : Journal of Chemical Physics. 115, 18, p. 8570-8574 5 p.

Research output: Contribution to journalArticle

Addition reactions
Adsorbates
Chemisorption
Hydrogenation
hydrogenation
149 Citations (Scopus)

Hydrophobic ionic liquids incorporating N-alkylisoquinolinium cations and their utilization in liquid-liquid separations

Visser, A. E., Holbrey, J. & Rogers, R. D., 07 Dec 2001, In : Chemical Communications. 23, p. 2484-2485 2 p.

Research output: Contribution to journalArticle

Ionic Liquids
Ionic liquids
Cations
Chlorobenzenes
Positive ions
7 Citations (Scopus)

Insight into electron-mediated reaction mechanisms: Catalytic CO oxidation on a ruthenium surface

Zhang, C. J., Hu, P. & Alavi, A., 08 May 2001, In : Journal of Chemical Physics. 114, 18, p. 8113-8118 6 p.

Research output: Contribution to journalArticle

Ruthenium
Catalytic oxidation
Carbon Monoxide
ruthenium
oxidation
411 Citations (Scopus)

Investigations of solvent-solute interactions in room temperature ionic liquids using solvatochromic dyes

Muldoon, M., Gordon, C. M. & Dunkin, I. R., Mar 2001, In : Journal of the Chemical Society- Perkin Transactions 2. 2, 4, p. 433-435 3 p.

Research output: Contribution to journalArticle

8 Citations (Scopus)

Ionic liquids: polar, but weakly coordinating solvents for the first biphasic oligomerisation of ethene to higher alpha-olefins with cationic Ni complexes (vol 17, pg 1523, 2001)

Wasserscheid, P., Gordon, C. M., Hilgers, C., Muldoon, M. & Dunkin, I. R., 2001, In : Chemical Communications. 1, p. 1700-1700 1 p.

Research output: Contribution to journalArticle

11 Citations (Scopus)

Liquid-liquid equilibria of ternary 2M1B/2M2B-2M1BOH-H2O and quaternary 2M1B-2M2B-2M1BOH-H2O mixtures

Aiouache, F. & Goto, S., 15 Sep 2001, In : Fluid Phase Equilibria. 187-188, p. 415-424 10 p.

Research output: Contribution to journalArticle

Liquids
liquids
Chemical analysis
50 Citations (Scopus)

Mechanism for the high reactivity of CO oxidation on a ruthenium-oxide

Liu, Z. P., Hu, P. & Alavi, A., 01 Apr 2001, In : Journal of Chemical Physics. 114, 13, p. 5956-5957 2 p.

Research output: Contribution to journalArticle

100 Citations (Scopus)

Molecular layering and local order in thin films of 1-alkyl-3-methylimidazolium ionic liquids using X-ray reflectivity

Carmichael, A. J., Hardacre, C., Holbrey, J., Nieuwenhuyzen, M. & Seddon, K., 20 May 2001, In : Molecular Physics. 99, 10, p. 795-800 6 p.

Research output: Contribution to journalArticle

Ionic Liquids
Salts
X-Rays
salts
reflectance
1 Citation (Scopus)

Observation of an optical phonon band in situ in TiO electrochemistry: A possible indicator of strongly trapped intermediates in the O evolution reaction

Christensen, P. A., Eameaim, J., Hamnett, A. & Lin, W. F., 31 Aug 2001, In : Chemical Physics Letters. 344, 5-6, p. 488-494 7 p.

Research output: Contribution to journalArticle

Electrochemistry
electrochemistry
Electrolytes
Irradiation
electrolytes

Predicting the UV-Vis Spectra of Oxazine Dyes

Fleming, S., Mills, A. & Tuttle, T., 2001, In : Journal of Organic Chemistry. 7, p. 432-441, Impact Factor: 2.8 10 p.

Research output: Contribution to journalArticle

9 Citations (Scopus)

Prediction of fertilizer granulation: Effect of binder viscosity on random coalescence model

Walker, G., Holland, C., Ahmad, M., Fox, J. N. & Kells, A. G., 02 May 2001, In : Industrial and Engineering Chemistry Research. 40, 9, p. 2128-2133 6 p.

Research output: Contribution to journalArticle

Preparation and characterisation of supported L(a0.)8Sr(0.2)MnO(3+x)

Burch, R., Harris, P. J. F. & Pipe, C., 2001, In : APPLIED CATALYSIS A-GENERAL. 210, p. 63-73 11 p.

Research output: Contribution to journalArticle

Aluminum Oxide
Catalyst supports
Catalysts
Alumina
Lanthanum
78 Citations (Scopus)

Quantitative Raman spectroscopy of highly fluorescent samples using pseudosecond derivatives and multivariate analysis

Bell, S., O'Grady, A., Dennis, A. C., Denvir, D. & McGarvey, J., 01 May 2001, In : Analytical Chemistry. 73(9), 9, p. 2058-2065 8 p.

Research output: Contribution to journalArticle

11 Citations (Scopus)
Mercuric Chloride
ammonium chlorides
containers
Containers
Copper
13 Citations (Scopus)

Regio- and stereo-selective dioxygenase-catalysed cis-dihydroxylation of fjord-region polycyclic arenes

Boyd, D., Sharma, N., Harrison, J. S., Kennedy, M. A., Allen, C. & Gibson, D. T., 2001, In : Journal of the Chemical Society - Perkin Transactions 1. 1, 11, p. 1264-1269 6 p.

Research output: Contribution to journalArticle

Dioxygenases
Thiophenes
Substrates
benzo(b)naphtho(1,2-d)thiophene
trans-1,2-dihydro-1,2-naphthalenediol
87 Citations (Scopus)

Ring-opening polymerisation of silver-diphosphine [M2L3] coordination cages to give [M2L3](infinity) coordination polymers

Lozano, E., James, S. & Nieuwenhuyzen, M., Jun 2001, In : Chemistry - A European Journal. 7(12), p. 2644-2651 8 p.

Research output: Contribution to journalArticle

Acetylene
Ring opening polymerization
Silver
Polymers
X ray crystallography
54 Citations (Scopus)

Softened C-H modes of adsorbed methyl and their implications for dehydrogenation: An ab initio study

Michaelides, A. & Hu, P., 08 Feb 2001, In : Journal of Chemical Physics. 114, 6, p. 2523-2526 4 p.

Research output: Contribution to journalArticle

Dehydrogenation
dehydrogenation
softening
methylidyne
Vibrational spectra
95 Citations (Scopus)

Solvation of 1-butyl-3-methylimidazolium hexafluorophosphate in aqueous ethanol - a green solution for dissolving 'hydrophobic' ionic liquids

Swatloski, R., Visser, A. E., Reichert, W. M., Broker, G. A., Farina, L. M., Holbrey, J. & Rogers, R. D., 21 Oct 2001, In : Chemical Communications. 20, p. 2070-2071 2 p.

Research output: Contribution to journalArticle

Ionic Liquids
Solvation
Ionic liquids
Ethanol
Purification
92 Citations (Scopus)

Sorption behavior of cationic and anionic dyes from aqueous solution on different types of activated carbons

Al-Degs, Y., Khraisheh, M., Allen, S. & Ahmad, M., 2001, In : Separation Science and Technology. 36, 1, p. 91-102 12 p.

Research output: Contribution to journalArticle

Activated carbon
Sorption
Coloring Agents
Dyes
Methylene Blue
28 Citations (Scopus)

Stepwise addition reactions in ammonia synthesis: A first principles study

Zhang, C. J., Liu, Z. H. & Hu, P., 08 Jul 2001, In : Journal of Chemical Physics. 115, 2, p. 609-611 3 p.

Research output: Contribution to journalArticle

Addition reactions
Ammonia
ammonia
synthesis
dissociation
141 Citations (Scopus)

Structural mimics for the active site of [NiFe] hydrogenase

Marr, A., Spencer, D. J. E. & Schroder, M., 2001, In : Coordination Chemistry Reviews. 219, p. 1055-1074 20 p.

Research output: Contribution to journalArticle

Hydrogenase
Cysteine
Molecular weight
Single crystals
X ray diffraction
70 Citations (Scopus)

Synthesis and reactivity of hexahydropyrroloquinolines

Stevenson, P., Hadden, M., Nieuwenhuyzen, M., Potts, D. & Thompson, N., 25 Jun 2001, In : Tetrahedron. 57(26), 26, p. 5615-5624 10 p.

Research output: Contribution to journalArticle

52 Citations (Scopus)

Synthesis of the heterocyclic core of the alkaloids martinelline and martinellic acid

Hadden, M., Nieuwenhuyzen, M., Osborne, D., Stevenson, P. & Thompson, N., 03 Sep 2001, In : Tetrahedron Letters, ISSN. 42, 36, p. 6417-6419 3 p.

Research output: Contribution to journalArticle

Stereochemistry
Imines
Cycloaddition
X ray crystallography
Cycloaddition Reaction

The application of Kudzu as a medium for the adsorption of heavy metals from dilute aqueous wastewaters.

Allen, S., Brown, P. & Brown, J., 2001, In : Bioresource Technology. 78, p. 195-201 7 p.

Research output: Contribution to journalArticle

18 Citations (Scopus)

The effect of SO2 on the activity of Pd-based catalysts in methane combustion

Burch, R., Crittle, D. J., Southward, B. W. L. & Sullivan, J. A., 2001, In : Catalysis Letters. 72, p. 153-155 3 p.

Research output: Contribution to journalArticle

Poisons
Methane
Catalyst supports
Catalysts
58 Citations (Scopus)

The effect of the addition of sodium compounds in the liquid-phase hydrodechlorination of chlorobenzene over palladium catalysts

Aramendia, M. A., Burch, R., Garcia, I. M., Marinas, A., Marinas, J. M., Southward, B. W. L. & Urbano, F. J., 17 May 2001, In : Applied Catalysis B: Environmental. 31, 3, p. 163-171 9 p.

Research output: Contribution to journalArticle

Sodium Compounds
Sodium compounds
chlorobenzene
palladium
Palladium
24 Citations (Scopus)

The electro-oxidations of methanol and formic acid at the Ru(0001) electrode as a function of temperature: In-situ FTIR studies

Lin, W. F., Christensen, P. A. & Hamnett, A., 01 Jan 2001, In : Physical Chemistry Chemical Physics . 3, 16, p. 3312-3319 8 p.

Research output: Contribution to journalArticle

formic acid
Electrooxidation
Carbon Monoxide
Methanol
methyl alcohol
76 Citations (Scopus)

The isolation and purification of tris-2,2'-bipyridine complexes of ruthenium(II) containing unsymmetrical ligands

Fletcher, N., Nieuwenhuyzen, M. & Rainey, S., 2001, In : Dalton Transactions. 18, p. 2641-2648 8 p.

Research output: Contribution to journalArticle

2,2'-Dipyridyl
Ruthenium
Purification
Isomers
Ligands
16 Citations (Scopus)

The nature of the active metal surface of catalysts for the clean combustion of biogas containing ammonia

Burch, R. & Southward, B. W. L., 2001, In : Journal of Catalysis. 198, 2, p. 286-295 10 p.

Research output: Contribution to journalArticle

117 Citations (Scopus)

The preparation of highly ordered single layer ZSM-5 coating on prefabricated stainless steel microchannels

Rebrov, E., Seijger, G. B. F., Calis, H. P. A., De Croon, M. H. J. M., Van Den Bleek, C. M. & Schouten, J. C., 2001, In : APPLIED CATALYSIS A-GENERAL. 206, p. 125-143 19 p.

Research output: Contribution to journalArticle

Stainless Steel
Microchannels
Stainless steel
Coatings
Crystals
15 Citations (Scopus)

Transmetalation reactions with nitrogen-containing

Albrecht, M., James, S., Veldman, N., Spek, A. L. & Van Koten, G., 2001, In : CANADIAN JOURNAL OF CHEMISTRY-REVUE CANADIENNE DE CHIMIE. 79, 5-6, p. 709-718 10 p.

Research output: Contribution to journalArticle

Nitrogen
33 Citations (Scopus)

Use of a batch rotating photocatalytic contactor for the degradation of organic pollutants in wastewater

Hamill, N. A., Weatherley, L. R. & Hardacre, C., 26 Feb 2001, In : Applied Catalysis B: Environmental. 30, 1-2, p. 49-60 12 p.

Research output: Contribution to journalArticle

Organic pollutants
organic pollutant
Wastewater
wastewater
Degradation
2002

[Ag(NH3)(2)]ClO4: Crystal structures, phase transition, and vibrational spectra

Nockemann, P. & Meyer, G., 2002, In : ZEITSCHRIFT FUR ANORGANISCHE UND ALLGEMEINE CHEMIE. 628, p. 1636-1640 5 p.

Research output: Contribution to journalArticle

Vibrational spectra
Crystal structure
Phase transitions
Ammonia
Anions
26 Citations (Scopus)

3D-QSAR studies on 4-Hydroxyphenylpyruvate Dioxygenase inhibitors by comparative molecular field analysis (CoMFA)

Huang, M., Yang, D-Y., Shang, Z., Zou, J. & Yu, Q., 02 Sep 2002, In : Bioorganic & Medicinal Chemistry. 12 (17), 17, p. 2271-2275 5 p.

Research output: Contribution to journalArticle

4-Hydroxyphenylpyruvate Dioxygenase
Quantitative Structure-Activity Relationship
Validation Studies
Esters
Ligands
62 Citations (Scopus)

4-Phenyloxazolidin-2-ones and isoindolin-1-ones; chiral auxiliaries for Diels-Alder reactions of N-substituted 1,3-dienes.

Stevenson, P., McAlonan, H., Murphy, J. P., Nieuwenhuyzen, M., Reynolds, K., Sarma, P. K. S. & Thompson, N., Jan 2002, In : Journal of the Chemical Society - Perkin Transactions 1. 1, 1, p. 69-79 11 p.

Research output: Contribution to journalArticle

5,5-Fused thiophene gamma-lactams as templates for serine protease inhibition

Migaud, M., Wilmouth, R. C., Mills, G. I., Wayne, G. J., Risley, C., Chambers, C., Macdonald, S. J. F. & Schofield, C. J., 21 Jun 2002, In : Chemical Communications. 12, 12, p. 1274-1275 2 p.

Research output: Contribution to journalArticle

17 Citations (Scopus)

Absolute configuration assignment and enantiopurity determination of chiral alkaloids and coumarins derived from O- and C-prenyl epoxides

Boyd, D., Sharma, N., Loke, P. L., Malone, J., McRoberts, W. C. & Hamilton, J., Nov 2002, In : Chemical Communications. *, 24, p. 3070-3071 2 p.

Research output: Contribution to journalArticle

Coumarins
Alkaloids
Epoxy Compounds
coumarin
prenyl
67 Citations (Scopus)

A concise Formal Synthesis of Luotonin A.

Stevenson, P. & Osborne, D., 29 Jul 2002, In : Tetrahedron Letters. 43(31), 31, p. 5469-5470 2 p.

Research output: Contribution to journalArticle

9 Citations (Scopus)

A density functional theory study of stepwise addition reactions in ammonia synthesis on Ru(0001)

Zhang, C. J., Lynch, M. & Hu, P., 2002, In : Surface Science. 496, p. 221-230 10 p.

Research output: Contribution to journalArticle

Addition reactions
Ammonia
Density functional theory
ammonia
density functional theory