Centre for Functional Materials

  • United Kingdom

Research Output

2020
Open Access

Optically-generated Overhauser dynamic nuclear polarization: A numerical analysis

Cheney, D. & Wedge, C., 21 Jan 2020, In : Journal of Chemical Physics. 152, 3, 14 p., 034202.

Research output: Contribution to journalArticle

Open Access
File
Open Access

Recent progress in ligand photorelease reaction mechanisms: Theoretical insights focusing on Ru(II) 3 MC states

Soupart, A., Alary, F., Heully, J-L., Elliott, P. I. P. & Dixon, I. M., 20 Jan 2020, In : Coordination Chemistry Reviews. 408, 10 p., 213184.

Research output: Contribution to journalReview article

1 Citation (Scopus)

The Energetics of Carbonated PuO2 Surfaces Affects Nanoparticle Morphology: A DFT+U Study

Moxon, S., Symington, A. R., Tse, J., Dawson, J., Flitcroft, J., Parker, S. C., Cooke, D., Harker, R. M. & Molinari, M., 11 Mar 2020, In : Physical Chemistry Chemical Physics.

Research output: Contribution to journalArticle

Unravelling the Mechanism of Excited-State Interligand Energy Transfer and the Engineering of Dual Emission in [Ir(C N) 2(N N)] + Complexes

Scattergood, P., Ranieri, A., Charalambou, L., Comia, A., Ross, D., Rice, C., Hardman, S., Heully, J-L., Dixon, I. M., Massi, M., Alary, F. & Elliott, P., 3 Feb 2020, In : Inorganic Chemistry. 59, 3, p. 1785-1803 19 p.

Research output: Contribution to journalArticle

2019

Accelerated weathering of textile waste nonwovens used as sustainable agricultural mulching

Abidi, H., Rana, S., Chaouch, W., Azouz, B., Ben Aissa, I., Ben Hassen, M. & Fangueiro, R., 9 Jun 2019, In : Journal of Industrial Textiles.

Research output: Contribution to journalArticle

Open Access
File

Characterizing Drug-Polymer Bead Interactions Using Isothermal Titration Calorimetry

Swaine, T., Garcia, P., Tang, Y., Lewis, A., Parkes, G. & Waters, L., 1 May 2019, In : Journal of Pharmaceutical Sciences. 108, 5, p. 1772-1778 7 p.

Research output: Contribution to journalArticle

Open Access
3 Citations (Scopus)

Controlling the {111}/{110} Surface Ratio of Cuboidal Ceria Nanoparticles

Castanet, U., Feral-Martin, C., Demourgues, A., Neal, R., Sayle, D., Caddeo, F., Flitcroft, J., Caygill, R., Pointon, B., Molinari, M. & Majimel, J., 27 Mar 2019, In : ACS applied materials & interfaces. 11, 12, p. 11384-11390 7 p.

Research output: Contribution to journalArticle

Open Access
File
5 Citations (Scopus)

Crown ether alkali metal TCNQ complexes revisited – the impact of smaller cation complexes on their solid-state architecture and properties

Bingjia Yan, Peter N Horton, Andrea E Russell, Wedge, C., Simon C Weston & Martin Christopher Grossel, 7 Jun 2019, In : CrystEngComm. 21, 21, p. 3273-3279 7 p.

Research output: Contribution to journalArticle

Dry‐jet wet electrospinning of native cellulose microfibers with macroporous structures from ionic liquids

Basel Bazbouz, M., Taylor, M., Baker, D., Ries, M. E. & Goswami, P., 10 Mar 2019, In : Journal of Applied Polymer Science. 136, 10, 17 p., 47153.

Research output: Contribution to journalArticle

Open Access
File
2 Citations (Scopus)

Factors affecting Removal of Bacterial Pathogens from Healthcare Surfaces during Dynamic Wiping

Edwards, N. W. M., Best, E. L., Goswami, P., Wilcox, M. & Russell, S. J., 1 Feb 2019, In : Textile Research Journal. 89, 4, p. 580-589 10 p.

Research output: Contribution to journalArticle

Open Access

Identification of decomposition volatile organic compounds from surface-deposited and submerged porcine remains

Irish, L., Rennie, S., Parkes, G. & Williams, A., 1 Sep 2019, In : Science and Justice. 59, 5, p. 503-515 13 p.

Research output: Contribution to journalArticle

Open Access
File

Impact of Hydrogen on the Intermediate Oxygen Clusters and Diffusion in Fluorite Structured UO 2+x

Flitcroft, J., Symington, A., Molinari, M., Brincat, N. A., Williams, N. R. & Parker, S. C., 2019, In : Inorganic Chemistry. 58, 6, p. 3774-3779 6 p.

Research output: Contribution to journalArticle

Open Access
File

Lornoxicam drug—A new study of thermal degradation under oxidative and pyrolysis conditions using the thermoanalytical techniques, DRX and LC-MS/MS

Carvalho, A. C. S., Zangaro, G. A. C., Fernandes, R. P., Ekawa, B., Nascimento, A. L. C. S., Silva, B. F., Ashton, G., Parkes, G., Ionashiro, M. & Caires, F. J., 1 Oct 2019, In : Thermochimica Acta. 680, 8 p., 178353.

Research output: Contribution to journalArticle

1 Citation (Scopus)

New chemical engineering provision: Quality in diversity

Brown, D. J., Campbell, G. M., Belton, D. J., Cox, P. W., Garcia-Trinanes, P. & Tizaoui, C., 1 Jul 2019, In : Education for Chemical Engineers. 28, p. 30-44 15 p.

Research output: Contribution to journalArticle

Open Access
File

Novel solid-state compounds of heavy rare-earth (III) picolinates. A pyrolytic study using: TG-DSC-IR, HSM-MS and GC-MS

Nascimento, A. L. C. S., Ashton, G., Parkes, G., Ekawa, B., Fernandes, R. P., Carvalho, A. C. S., Ionashiro, M. & Caires, F. J., 1 Nov 2019, In : Journal of Analytical and Applied Pyrolysis. 144, 9 p., 104709.

Research output: Contribution to journalArticle

Observation of an Inversion in Photophysical Tuning in a Systematic Study of Luminescent Triazole-Based Osmium(II) Complexes

Scattergood, P., Roberts, J., Omar, S. & Elliott, P., 1 Jul 2019, In : Inorganic Chemistry. 58, 13, p. 8607-8621 15 p.

Research output: Contribution to journalArticle

Polyamide 6 and Thermoplastic Polyurethane Recycled Hybrid Fibres Via Twin-Screw Melt Extrusion

Kunchimon, S. Z., Tausif, M., Goswami, P. & Cheung, V., 1 Jul 2019, In : Journal of Polymer Research. 26, 7, 14 p., 162.

Research output: Contribution to journalArticle

4 Citations (Scopus)

Quantification of the adsorption of benzoates on poly(dimethylsiloxane) membrane

Waters, L., Jesney, H., Molinari, M. & Shahzad, Y., 1 Sep 2019, In : European Polymer Journal. 118, p. 286-289 4 p.

Research output: Contribution to journalArticle

Study of the thermal behavior in oxidative and pyrolysis conditions of some transition metals complexes with Lornoxicam as ligand using the techniques: TG-DSC, DSC, HSM and EGA (TG-FTIR and HSM-MS)

Zangaro, G. A. C., Carvalho, A. C. S., Ekawa, B., do Nascimento, A. L. C. S., Nunes, W. D. G., Fernandes, R. P., Parkes, G. M. B., Ashton, G. P., Ionashiro, M. & Caires, F. J., 1 Nov 2019, In : Thermochimica Acta. 681, 10 p., 178399.

Research output: Contribution to journalArticle

2018

Applications of light-induced hyperpolarization in EPR and NMR

Cheney, D. & Wedge, C., 6 Nov 2018, Electron Paramagnetic Resonance. Chechik, V. & Murphy, D. M. (eds.). Royal Society of Chemistry, Vol. 26. p. 89-129 41 p. (SPR - Electron Paramagnetic Resonance).

Research output: Chapter in Book/Report/Conference proceedingChapter

2 Citations (Scopus)

Combined EXAFS and ab initio study of copper complex geometries adsorbed on natural illite

Martins, D. M. S., Mirão, J. P., Göttlicher, J., Molinari, M., Steininger, R., Parker, S. C. & Gonçalves, M. A., Feb 2018, In : Applied Clay Science. 152, p. 73-82 10 p.

Research output: Contribution to journalArticle

Open Access
File

Enhancing the dissolution of phenylbutazone using Syloid® based mesoporous silicas for oral equine applications

Waters, L. J., Hanrahan, J. P., Tobin, J. M., Finch, C. V., Parkes, G. M. B., Ahmad, S. A., Mohammad, F. & Saleem, M., Jun 2018, In : Journal of Pharmaceutical Analysis. 8, 3, p. 181-186 6 p.

Research output: Contribution to journalArticle

Open Access
6 Citations (Scopus)

Enrichment of cellulose acetate nanofibre assemblies for therapeutic delivery of L-tryptophan

Ghorani, B., Goswami, P., Blackburn, R. S. & Russell, S. J., Mar 2018, In : International Journal of Biological Macromolecules. 108, p. 1-8 8 p.

Research output: Contribution to journalArticle

Open Access
4 Citations (Scopus)

Exploration of Uncharted 3PES Territory for [Ru(bpy)3]2+: A New 3MC Minimum Prone to Ligand Loss Photochemistry

Soupart, A., Alary, F., Heully, J-L., Elliott, P. & Dixon, I. M., 19 Mar 2018, In : Inorganic Chemistry. 57, 6, p. 3192-3196 5 p.

Research output: Contribution to journalArticle

Open Access
File
11 Citations (Scopus)

Incorporating physiologically relevant mobile phases in micellar liquid chromatography for the prediction of human intestinal absorption

Shokry, D., Waters, L., Parkes, G. & Mitchell, J. C., Dec 2018, In : Biomedical Chromatography. 32, 12, 9 p., e4351.

Research output: Contribution to journalArticle

Open Access
File
1 Citation (Scopus)

Limitations of Monoolein in Simulating Water-in-Fuel Characteristics of EN590 Diesel containing Biodiesel in Water Separation Testing

Arouni, H., Farooq, U., Goswami, P., Kapur, N. & Russell, S. J., 2018, In : SAE International Journal of Fuels and Lubricants. 11, 3, p. 229-238 10 p., 04-11-03-0012.

Research output: Contribution to journalArticle

Open Access
File
1 Citation (Scopus)

Mitochondria-localising DNA-binding biscyclometalated phenyltriazole iridium(III) dipyridophenazene complexes: Syntheses and cellular imaging properties

Sreedharan, S., Sinopoli, A., Jarman, P. J., Robinson, D., Clemmet, C., Scattergood, P., Rice, C., Smythe, C. G. W., Thomas, J. & Elliott, P., 2018, In : Dalton Transactions. 47, 14, p. 4931-4940 10 p.

Research output: Contribution to journalArticle

Open Access
File
6 Citations (Scopus)

Multiscale design of ZnO nanostructured photocatalysts

Ramirez-canon, A., Medina-llamas, M., Vezzoli, M. & Mattia, D., 2018, In : Physical Chemistry Chemical Physics. 20, 9, p. 6648-6656 9 p.

Research output: Contribution to journalArticle

Open Access
10 Citations (Scopus)

Negatively Photochromic Organic Compounds: Exploring the Dark Side

Aiken, S., Edgar, R., Gabbutt, C., Heron, B. M. & Hobson, P. A., Feb 2018, In : Dyes and Pigments. 149, p. 92-121 30 p.

Research output: Contribution to journalReview article

Open Access
24 Citations (Scopus)

Prospects for Engineering Thermoelectric Properties in La1/3NbO3 Ceramics Revealed via Atomic-Level Characterization and Modeling

Kepaptsoglou, D., Baran, J. D., Azough, F., Ekren, D., Srivastava, D., Molinari, M., Parker, S. C., Ramasse, Q. M. & Freer, R., 2 Jan 2018, In : Inorganic Chemistry. 57, 1, p. 45-55 11 p.

Research output: Contribution to journalArticle

Open Access
File
3 Citations (Scopus)

Protecting ceria nanocatalysts-The role of sacrificial barriers

Morgan, L. M., Molinari, M., Corrias, A. & Sayle, D. C., 26 Sep 2018, In : ACS Applied Materials and Interfaces. 10, 38, p. 32510-32515 6 p.

Research output: Contribution to journalArticle

Open Access
1 Citation (Scopus)

Ruthenium-containing Linear Helicates and Mesocates with Tuneable p53 Selective Cytotoxicity in Colorectal Cancer Cells.

Allison, S., Cooke, D., Davidson, F. S., Elliott, P., Faulkner, R., Griffiths, H., Harper, O., Hussain, O., Owen-Lynch, P., Phillips, R., Rice, C., Shepherd, S. & Wheelhouse, R. T., 26 Jul 2018, In : Angewandte Chemie - International Edition. 57, 31, p. 9799-9804 6 p.

Research output: Contribution to journalArticle

Open Access
File
6 Citations (Scopus)

Synergistic adsorption of Cd(II) with sulfate/phosphate on ferrihydrite: An in situ ATR-FTIR/2D-COS study

Liu, J., Zhu, R., Liang, X., Ma, L., Lin, X., Zhu, J., He, H., Parker, S. C. & Molinari, M., 20 Jan 2018, In : Chemical Geology. 477, p. 12-21 10 p.

Research output: Contribution to journalArticle

Open Access
File
20 Citations (Scopus)

The critical role of hydrogen on the stability of oxy-hydroxyl defect clusters in uranium oxide

Flitcroft, J. M., Molinari, M., Brincat, N. A., Williams, N. R., Storr, M. T., Allen, G. C. & Parker, S. C., 4 Jun 2018, In : Journal of Materials Chemistry A. 6, 24, p. 11362-11369 8 p.

Research output: Contribution to journalArticle

Open Access
5 Citations (Scopus)

Thermal analysis in oxidative and pyrolysis conditions of alkaline earth metals picolinates using the techniques: TG-DSC, DSC, MWTA, HSM and EGA (TG-DSC-FTIR and HSM-MS)

Nascimento, A. L. C. S., Parkes, G. M. B., Ashton, G. P., Fernandes, R. P., Teixeira, J. A., Nunes, W. D. G., Ionashiro, M. & Caires, F. J., 1 Oct 2018, In : Journal of Analytical and Applied Pyrolysis. 135, p. 67-75 9 p.

Research output: Contribution to journalArticle

Open Access
File
4 Citations (Scopus)
2017
Open Access
File
1 Citation (Scopus)
Open Access
File
25 Citations (Scopus)

Carbonation of Hydrous Materials at the Molecular Level: A Time of Flight-Secondary Ion Mass Spectrometry, Raman and Density Functional Theory Study

Pesce, G. L., Fletcher, I. W., Grant, J., Molinari, M., Parker, S. C. & Ball, R. J., 1 Mar 2017, In : Crystal Growth and Design. 17, 3, p. 1036-1044 9 p.

Research output: Contribution to journalArticle

Open Access
7 Citations (Scopus)

Concurrent La and A-Site Vacancy Doping Modulates the Thermoelectric Response to SrTiO3: Experimental and Computational Evidence

Azough, F., Jackson, S. S., Ekren, D., Freer, R., Molinari, M., Yeandel, S. R., Panchmatia, P., Parker, S. C., Maldonado, D. H., Kepaptsoglou, D. & Ramasse, Q. M., 6 Dec 2017, In : ACS Applied Materials and Interfaces. 9, 48, p. 41988-42000 13 p.

Research output: Contribution to journalArticle

Open Access
File
11 Citations (Scopus)

Control of metallo-supramolecular assemblies via steric, hydrogen bonding and argentophilic interactions; formation of a 3-dimensional polymer of circular helicates

Bullock, S. J., Davidson, F. S., Faulkner, R. A., Parkes, G. M. B., Rice, C. R. & Towns-Andrews, E., 9 Jan 2017, In : CrystEngComm. 19, 9, p. 1273-1278 6 p.

Research output: Contribution to journalArticle

Open Access
2 Citations (Scopus)

Fabric Finishing

Hebden, A. & Goswami, P., 21 Nov 2017, Textile and Clothing Design Technology. Cassidy, T. & Goswami, P. (eds.). CRC Press, p. 357-374

Research output: Chapter in Book/Report/Conference proceedingChapter

Fibers and Filaments

Goswami, P. & O’Hare, T., 21 Nov 2017, Textile and Clothing Design Technology. Cassidy, T. & Goswami, P. (eds.). CRC Press, p. 5-26

Research output: Chapter in Book/Report/Conference proceedingChapter

Introduction

Cassidy, T. & Goswami, P., 21 Nov 2017, Textile and Clothing Design Technology. Cassidy, T. & Goswami, P. (eds.). CRC Press, p. 1-4 4 p.

Research output: Chapter in Book/Report/Conference proceedingChapter

Investigation of a new bis(carboxylate)triazole-based anchoring ligand for dye-sensitised solar cell chromophore complexes

Sinopoli, A., Black, F. A., Wood, C. J., Gibson, E. & Elliott, P. I., 5 Jan 2017, In : Dalton Transactions. 46, 5, p. 1520-1530 11 p.

Research output: Contribution to journalArticle

Open Access
6 Citations (Scopus)

Macro and nanodimensional plant fiber reinforcements for cementitious composites

Parveen, S., Rana, S. & Fangueiro, R., 1 Jan 2017, Sustainable and Nonconventional Construction Materials using Inorganic Bonded Fiber Composites. Savastano Junior, H., Fiorelli, J. & Dos Santos, S. F. (eds.). Elsevier Inc., p. 343-382 40 p.

Research output: Chapter in Book/Report/Conference proceedingChapter

5 Citations (Scopus)

Methods for producing sporting goods

Nurnberg, H-P., Hanson, H. N., Prissok, F., Lohner, M., Drummer, D. K., Vetter, J., Lucht, M., Hohensinner, H., Schmidt, A., Stark, N., Schmidt, W., Hohenberger, M., Lintner, S., Tausif, M., O'Hare, T., Goswami, P. & Russell, S. J., 28 Nov 2017, (Submitted) Patent No. US20180147752A1, Priority date 31 May 2018, Priority No. US20180147752A1

Research output: Patent

8 Citations (Scopus)