Centre for Sustainable Chemical Technologies (CSCT)

Research Output 1983 2020

2011

Computer modelling of molecular adsorption at mineral interfaces

Crabtree, J., 19 Dec 2011.

Research output: Contribution to conferencePoster

Conversion of carbon dioxide into useful feedstocks using carbon nanotube supports

Minett, D., Mattia, D. & Jones, M., 6 Jun 2011, (Unpublished).

Research output: Contribution to conferencePoster

Conversion of carbon dioxide into useful feedstocks using carbon nanotube supports - talk

Minett, D., Mattia, D. & Jones, M., 6 Jun 2011, (Unpublished).

Research output: Contribution to conferenceOther

22 Downloads (Pure)

Copper exchanged zeolites for ammonia reduction of NOx from biogas gas engines

Mcclymont, D., 11 Jul 2011, (Unpublished).

Research output: Contribution to conferencePoster

File
Zeolites
Gas engines
Biofuels
Ammonia
Copper
13 Citations (Scopus)
62 Downloads (Pure)

Determination of the Poisson ratio of (001) and (111) oriented thin films of In(2)O(3) by synchrotron-based x-ray diffraction

Zhang, K. H. L., Regoutz, A., Palgrave, R. G., Payne, D. J., Egdell, R. G., Walsh, A., Collins, S. P., Wermeille, D. & Cowley, R. A., 1 Dec 2011, In : Physical Review B. 84, 23, 233301.

Research output: Contribution to journalArticle

File
Poisson ratio
Synchrotrons
Lattice constants
lattice parameters
synchrotrons

Development of Responsive Wound Dressings for Treatment of Burns and Wound Site Infections

Perez Esteban, P., Jenkins, A., Enright, M. & Arnot, T., 2011.

Research output: Contribution to conferencePoster

6 Citations (Scopus)
84 Downloads (Pure)

Electrode processes at gas | salt | Pd nanoparticle | glassy carbon electrode contacts: salt effects on the oxidation of formic acid vapor and the oxidation of hydrogen

Xia, F., Dale, S. E. C., Webster, R. A., Pan, M., Mu, S. C., Tsang, S. C., Mitchels, J. M. & Marken, F., 2011, In : New Journal of Chemistry. 35, 9, p. 1855-1860 6 p.

Research output: Contribution to journalArticle

Open Access
File
formic acid
Formic acid
Glassy carbon
Palladium
Hydrogen
19 Citations (Scopus)
90 Downloads (Pure)

Electron and hole stability in GaN and ZnO

Walsh, A., Catlow, C. R. A., Miskufova, M. & Sokol, A. A., 24 Aug 2011, In : Journal of Physics-Condensed Matter. 23, 33, 334217.

Research output: Contribution to journalArticle

Open Access
File
thermodynamics
Electrons
ionization potentials
Thermodynamics
conduction electrons

Embedding manganese doped zinc sulfide quantum dots in gallium nitride LEDs based on photonic crystals

Silver, J., Yan, X., Withnall, R., Fern, G., Sumner, J., Shields, P. & Allsopp, D., 2011, Proceedings of the International Display Workshops. Vol. 3. p. 1405-1408 4 p.

Research output: Chapter in Book/Report/Conference proceedingConference contribution

zinc sulfides
gallium nitrides
embedding
manganese
light emitting diodes

EPR studies of hole and electron trapping in titania photocatalysts

Howe, R., Macdonald, R., Dixon, S. & Holt, E., 1 Jan 2011, 241st ACS National Meeting and Exposition. American Chemical Society, (ACS National Meeting Book of Abstracts).

Research output: Chapter in Book/Report/Conference proceedingConference contribution

titanium
trapping
rutile
anatase
electrons

Experimental and CFD Studies of Fluid Dynamic Gauging in Cross-Flow Microfiltration Systems

Lewis, W., Chew, J. & Bird, M., 2011, 11th International Congress on Engineering and Food (ICEF11).

Research output: Chapter in Book/Report/Conference proceedingConference contribution

11 Citations (Scopus)
82 Downloads (Pure)

Free energy of defect formation: Thermodynamics of anion Frenkel pairs in indium oxide

Walsh, A., Sokol, A. A. & Catlow, C. R. A., 2011, In : Physical Review B. 83, 22, 224105.

Research output: Contribution to journalArticle

File
indium oxides
Indium
Free energy
Anions
Negative ions

High-pressure experimental data collection, analysis and modelling of hydrogen storage on nanoporous materials

Bimbo, N. M., Hruzewicz-Kolodziejczyk, A., Ting, V. & Mays, T. J., 2011.

Research output: Contribution to conferencePoster

Hydrogen storage
Adsorbents
Adsorption
Hydrogen
Gases
1 Citation (Scopus)

Horning-crown diamine complexes and salts; proton transfer mediated by solid-state intermolecular hydrogen bonding

Luciawati, F., Higham, L. T., Strauss, C. & Scott, J. L., 2011, In : CrystEngComm. 13, 1, p. 167-176

Research output: Contribution to journalArticle

Proton transfer
Diamines
diamines
Hydrogen bonds
Salts
1 Citation (Scopus)

Incorporating cerium doped yttrium aluminium garnet (YAG:Ce) nanophosphors into gallium nitride LEDs based on photonic crystals

Withnall, R., Silver, J., Catherall, C., Ireland, T. G., Fern, G. R., Sumner, J. W. S., Shields, P., Allsopp, D., Reip, P. W. & Subbiah, S., 2011, Proceedings of the International Display Workshops. Vol. 3. p. 1413-1416 4 p.

Research output: Chapter in Book/Report/Conference proceedingConference contribution

gallium nitrides
cerium
yttrium-aluminum garnet
light emitting diodes
photonics
31 Downloads (Pure)

iSusLab: A Sakai-based Virtual Research Environment for scientists

Cope, J., 28 Sep 2011.

Research output: Contribution to conferenceAbstract

Open Access
File
resources
data bank
intellectual property
science
experience
18 Downloads (Pure)

LED lighting: oxidation of GaN from ab initio thermodynamic modelling

Jackson, A., Allsopp, D. & Walsh, A., 9 Jul 2011.

Research output: Contribution to conferencePoster

File

Long-term hydrogen storage approach for 5MW micro-power generator using wind turbines

Yu, S., Mays, T. J. & Dunn, R. W., 2011, Proceedings of the tenth IASTED European conference on power and energy systems . Bourkas, P. (ed.). Anaheim, CA: ACTA Press, p. 267-273 7 p.

Research output: Chapter in Book/Report/Conference proceedingConference contribution

Hydrogen storage
Wind turbines
Energy storage
Wind power
Energy dissipation

Low temperature copper catalysed rearrangment of oximes to amides

Lynch, J., 2011.

Research output: Contribution to conferencePoster

Oximes
Amides
Copper
Phosphates
Catalysts

Low temperature precursors for the metal organic chemical vapour deposition of transparent conducting oxides

Wildsmith, T., Hill, M., Johnson, A., Molloy, K. & Kingsley, A. J., 31 Jul 2011.

Research output: Contribution to conferencePoster

Low temperature precursors for the metal organic chemical vapour deposition of transparent conducting oxides

Wildsmith, T., Hill, M., Johnson, A., Molloy, K. & Kingsley, A. J., 15 Jul 2011.

Research output: Contribution to conferencePoster

114 Citations (Scopus)

Mechanistic investigation and reaction kinetics of the low-pressure copolymerization of cyclohexene oxide and carbon dioxide catalyzed by a dizinc complex

Jutz, F., Buchard, A., Kember, M. R., Fredriksen, S. B. & Williams, C. K., 5 Oct 2011, In : Journal of the American Chemical Society. 133, 43, p. 17395-17405 11 p.

Research output: Contribution to journalArticle

Carbon Dioxide
Reaction kinetics
Copolymerization
Carbon dioxide
Molecular Weight

Molecular modelling of carbon dioxide adsorption in zeolites

Crabtree, J., 11 Jul 2011.

Research output: Contribution to conferenceAbstract

Molecular Modelling of Carbon Dioxide Adsorption in Zeolites

Crabtree, J., 29 Sep 2011.

Research output: Contribution to conferencePoster

Molecular Modelling of Carbon Dioxide Adsorption in Zeolites

Crabtree, J., 17 Aug 2011.

Research output: Contribution to conferencePoster

19 Downloads (Pure)

Multi-Step TPSR/QMS Technique to Study the Kinetics of NH3-SCR

Mcclymont, D., 4 Sep 2011, (Unpublished).

Research output: Contribution to conferencePoster

File
Zeolites
Thyristors
Catalysts
Kinetics
Ammonia

Nanocrystals of MIL-101 with adjustable sizes for CO2 capture

Burrows, A., Jiang, D., Edler, K. & Raithby, P., 2011.

Research output: Contribution to conferencePoster

Nanostructured polymer-surfactant films for encapsulation/release

Edler, K., Holdaway, J. & Wasbrough, M., 2011.

Research output: Contribution to conferencePaper

Encapsulation
Surface-Active Agents
Polymers
Polyethyleneimine
Cationic surfactants
61 Citations (Scopus)
66 Downloads (Pure)

Nature of the band gap and origin of the conductivity of PbO(2) revealed by theory and experiment

Scanlon, D. O., Kehoe, A. B., Watson, G. W., Jones, M. O., David, W. I. F., Payne, D. J., Egdell, R. G., Edwards, P. P. & Walsh, A., 7 Dec 2011, In : Physical Review Letters. 107, 24, 246402.

Research output: Contribution to journalArticle

File
conductivity
oxygen
lead acid batteries
forbidden bands
Bryophytes

Operations Strategy (3rd edition)

Lewis, M., 2011, Pearson Education.

Research output: Book/ReportBook

11 Downloads (Pure)

Oxidation of GaN for light conversion: Ab initio thermodynamic modelling

Jackson, A., Allsopp, D. & Walsh, A., 19 Dec 2011.

Research output: Contribution to conferencePoster

File

Oxidised cellulose gels and films for encapsulation and release

Celebi, D., 2011.

Research output: Contribution to conferencePoster

Oxidised cellulose gels and films for encapsulation and release

Celebi, D., 2011.

Research output: Contribution to conferencePoster

PAN-pyrene-micelle based sensors for metal ions

Edler, K. & Jaber, R., 2011.

Research output: Contribution to conferencePaper

Micelles
Metal ions
Sensors
Surface-Active Agents
Polymers

Polarization properties of light diffracted off 2D photonic crystal

Šoltýs, J., Chlpík, J., Držík, M., Šatka, A., Lewis, R., Bowen, C. & Allsopp, D., 2011, Proceedings of the 17th Conference of Czech and Slovak Physicists. Slovak Physical Society, p. 97-98 2 p.

Research output: Chapter in Book/Report/Conference proceedingConference contribution

Selective incorporation of ligands into mixed-component metal-organic frameworks

Burrows, A., Fisher, L., Richardson, C. & Rigby, S., 2011.

Research output: Contribution to conferencePoster

259 Citations (Scopus)
98 Downloads (Pure)

Stereochemistry of post-transition metal oxides: revision of the classical lone pair model

Walsh, A., Payne, D. J., Egdell, R. G. & Watson, G. W., 2011, In : Chemical Society Reviews. 40, 9, p. 4455-4463 9 p.

Research output: Contribution to journalArticle

File
Stereochemistry
Oxides
Transition metals
Metals
Jahn-Teller effect
39 Citations (Scopus)
59 Downloads (Pure)

Strontium migration assisted by oxygen vacancies in SrTiO3 from classical and quantum mechanical simulations

Walsh, A., Catlow, C. R. A., Smith, A. G. H., Sokol, A. A. & Woodley, S. M., 3 Jun 2011, In : Physical Review B. 83, 22, 220301.

Research output: Contribution to journalArticle

File
Strontium
Oxygen vacancies
strontium
Ions
oxygen
118 Citations (Scopus)
89 Downloads (Pure)

Structural diversity and electronic properties of Cu(2)SnX(3) (X = S, Se): A first-principles investigation

Zhai, Y. T., Chen, S. Y., Yang, J. H., Xiang, H. J., Gong, X. G., Walsh, A., Kang, J. & Wei, S. H., 15 Aug 2011, In : Physical Review B. 84, 7, 075213.

Research output: Contribution to journalArticle

File
Electronic properties
Anions
Cations
Energy gap
Negative ions
57 Citations (Scopus)
79 Downloads (Pure)

Surface oxygen vacancy origin of electron accumulation in indium oxide

Walsh, A., 27 Jun 2011, In : Applied Physics Letters. 98, 26, 261910.

Research output: Contribution to journalArticle

File
indium oxides
metal oxides
oxygen
insulation
electron gas
3 Citations (Scopus)
Ligands
Nuclear magnetic resonance spectroscopy
Substitution reactions
Salts
Metals

Synthesis of copper dyes for use in dye-sensitized solar cells

Wills, K., 2011.

Research output: Contribution to conferencePoster

6 Citations (Scopus)

Synthetic methods Part (II): Oxidation and reduction methods

Asghar, S. F. & Lewis, S. E., 10 Aug 2011, In : Annual Reports on the Progress of Chemistry - Section B. 107, p. 34-67 34 p.

Research output: Contribution to journalReview article

Street Drugs
Amphetamine
Sewage
Substance-Related Disorders
Epidemiology
2010
4 Citations (Scopus)

Acid activation of titanium alkoxide systems: structural characterisation of Ti(IV) sulfonyl-imide complexes

Johnson, A., Davidson, M. G., Jones, M. D. & Lunn, M. D., 20 Jun 2010, In : Inorganica Chimica Acta. 363, 10, p. 2209-2214 6 p.

Research output: Contribution to journalArticle

Imides
Acylation
Imines
imides
alkoxides
46 Citations (Scopus)

Alternatives to organoboron reagents in rhodium-catalyzed conjugate additions

Hargrave, J. D., Allen, J. C. & Frost, C. G., 1 Mar 2010, In : Chemistry - An Asian Journal. 5, 3, p. 386-396 11 p.

Research output: Contribution to journalArticle

Rhodium
Carbon
Organometallics
Addition reactions
Alkenes
909 Citations (Scopus)
229 Downloads (Pure)

An overview of CO2 capture technologies

MacDowell, N., Florin, N., Buchard, A., Hallett, J., Galindo, A., Jackson, G., Adjiman, C. S., Williams, C. K., Shah, N. & Fennell, P., 2010, In : Energy & Environmental Science. 3, 11, p. 1645-1669 25 p.

Research output: Contribution to journalArticle

Open Access
File
Carbon Monoxide
Ionic Liquids
Carbon capture
Carbonates
Liquid fuels
55 Citations (Scopus)

A Water Soluble Donor-Acceptor [2]Catenane that Can Switch between a Coplanar and a Gemini-Sign Conformation

Au-Yeung, H. Y., Pantos, G. D. & Sanders, J. K. M., 16 Jul 2010, In : Angewandte Chemie-International Edition. 49, 31, p. 5331-5334 4 p.

Research output: Contribution to journalArticle