Items where Division is "Department of Chemistry" and Year is 2022

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Number of items: 58.

Article

Akbar, S. ORCID: https://orcid.org/0000-0002-9456-3861, Elliott, J. M. ORCID: https://orcid.org/0000-0001-7469-4154, Squires, A. M. and Anwar, A. ORCID: https://orcid.org/0000-0002-2991-0281 (2022) Use of cubic structure with primitive nanochannels for fabrication of free standing 3D nanowire network of Pt with Pm3m symmetry. Nanotechnology, 33 (19). 195602. ISSN 1361-6528 doi: 10.1088/1361-6528/ac4f16

Aldowiesh, A., Mangelis, P., Vaqueiro, P. ORCID: https://orcid.org/0000-0001-7545-6262 and Powell, A. V. (2022) The impact of a magnetic ion on the thermoelectric properties of copper-rich quaternary selenides. Journal of Physics: Energy, 4 (3). 034001. ISSN 2515-7655 doi: 10.1088/2515-7655/ac6a11

Aldred, P. L., Leroux, F., Colquhoun, H. M. and Aricò, F. (2022) Unravelling the crystal and molecular structure of a 1,3-linked aromatic poly(ether-ketone). Materials Today - Chemistry, 24. 100853. ISSN 2468-5194 doi: 10.1016/j.mtchem.2022.100853

Aljuaid, N., Seitsonen, J., Ruokolainen, J., Greco, F. ORCID: https://orcid.org/0000-0001-7934-0056 and Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926 (2022) Micelle and nanotape formation of Benzene Tricarboxamide analogues with selective cancer cell cytotoxicity. ACS Omega, 7 (50). pp. 46843-46848. ISSN 2470-1343 doi: 10.1021/acsomega.2c05940

Antunes, L. M. ORCID: https://orcid.org/0000-0002-4867-5635, Grau-Crespo, R. ORCID: https://orcid.org/0000-0001-8845-1719 and Butler, K. T. ORCID: https://orcid.org/0000-0001-5432-5597 (2022) Distributed representations of atoms and materials for machine learning. npj Computational Materials, 8 (1). 44. ISSN 2057-3960 doi: 10.1038/s41524-022-00729-3

Bag, R. ORCID: https://orcid.org/0000-0001-8378-053X, Sikdar, Y. ORCID: https://orcid.org/0000-0002-1146-9950, Sahu, S., Bag, J. ORCID: https://orcid.org/0000-0002-7087-0867, Drew, M. G. B., Pal, K. ORCID: https://orcid.org/0000-0003-4422-6450 and Goswami, S. ORCID: https://orcid.org/0000-0002-1045-2508 (2022) Strategic substitution of −OH/−NR 2 (R=Et, Me) imparts colorimetric switching between F − and Hg 2+ by salicyaldehyde/benzaldehyde‐quinoxaline conjugates. ChemPhysChem, 23 (4). e202100718. ISSN 1439-7641 doi: 10.1002/cphc.202100718

Baker, B. C., O'Donnell, A. D., Sonkar, P., Hyder, M., German, I. M. and Hayes, W. ORCID: https://orcid.org/0000-0003-0047-2991 (2022) A supramolecular glass made from a low molecular weight amino acid derivative. European Polymer Journal, 162. 110889. ISSN 0014-3057 doi: 10.1016/j.eurpolymj.2021.110889

Basham, V., Hancock, T., McKendrick, J. ORCID: https://orcid.org/0000-0003-2275-0569, Tessarolo, N. and Wicking, C. (2022) Detailed chemical analysis of a fully formulated oil using dielectric barrier discharge ionisation-mass spectrometry. Rapid Communications in Mass Spectrometry, 36 (14). e9320. ISSN 1097-0231 doi: 10.1002/rcm.9320

Carrillo-Berdugo, I., Sampalo-Guzmán, J., Grau-Crespo, R. ORCID: https://orcid.org/0000-0001-8845-1719, Zorrilla, D. and Navas, J. (2022) Interface chemistry effects in nanofluids: Experimental and computational study of oil-based nanofluids with gold nanoplates. Journal of Molecular Liquids, 362. 119762. ISSN 0167-7322 doi: 10.1016/j.molliq.2022.119762

Castelletto, V. ORCID: https://orcid.org/0000-0002-3705-0162 and Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926 (2022) Amyloid and hydrogel formation of a peptide sequence from a coronavirus spike protein. ACS Nano, 16 (2). pp. 1857-1867. ISSN 1936-086X doi: 10.1021/acsnano.1c10658

Castelletto, V., de Mello, L. ORCID: https://orcid.org/0000-0001-7630-5087, Arfara, F., Iatrou, H. ORCID: https://orcid.org/0000-0001-9358-0769, Seitsonen, J. and Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926 (2022) Influence of polymer molar mass and mixture stoichiometry on polyelectrolyte complexes of poly(l-arginine) and Poly(l-glutamic acid). Polymer, 263. 125497. ISSN 0032-3861 doi: 10.1016/j.polymer.2022.125497

Challen, B. and Cramer, R. ORCID: https://orcid.org/0000-0002-8037-2511 (2022) Advances in ionisation techniques for mass spectrometry‐based omics research. Proteomics, 22 (15-16). 2100394. ISSN 1615-9853 doi: 10.1002/pmic.202100394

Chen, H., Hart, L. R., Hayes, W. ORCID: https://orcid.org/0000-0003-0047-2991 and Siviour, C. R. (2022) Experimental characterisation and modelling of the strain rate dependent mechanical response of a filled thermo-reversible supramolecular polyurethane. International Journal of Impact Engineering, 166. 104239. ISSN 0734-743X doi: 10.1016/j.ijimpeng.2022.104239

Clarke, C. J. ORCID: https://orcid.org/0000-0003-2698-3490, Baaqel, H., Matthews, R. P. ORCID: https://orcid.org/0000-0003-3328-4954, Chen, Y., Lovelock, K. R. J. ORCID: https://orcid.org/0000-0003-1431-269X, Hallett, J. P. ORCID: https://orcid.org/0000-0003-3431-2371 and Licence, P. ORCID: https://orcid.org/0000-0003-2992-0153 (2022) Halometallate ionic liquids: thermal properties, decomposition pathways, and life cycle considerations. Green Chemistry, 24 (15). pp. 5800-5812. ISSN 1463-9270 doi: 10.1039/d2gc01983c

Dalla Pozza, M., Abdullrahman, A., Cardin, C. J. ORCID: https://orcid.org/0000-0002-2556-9995, Gasser, G. and Hall, J. P. ORCID: https://orcid.org/0000-0003-3716-4378 (2022) Three’s a crowd – stabilisation, structure, and applications of DNA triplexes. Chemical Science (35). pp. 10193-10215. ISSN 2041-6539 doi: 10.1039/d2sc01793h

Das, C., Mondal, A., Sengupta, S., Cardin, C. ORCID: https://orcid.org/0000-0002-2556-9995 and Chattopadhyay, S. K. (2022) Selective cyanide sensing using a Fe(III) complex of pyridoxal-beta alanine Schiff base. Spectrochimica Acta Part a-Molecular and Biomolecular Spectroscopy, 273. 120943. ISSN 1386-1425 doi: 10.1016/j.saa.2022.120943

Doherty, S. ORCID: https://orcid.org/0000-0003-1103-8090, Knight, J. G., Alharbi, H. Y., Paterson, R., Wills, C., Dixon, C., Šiller, L., Chamberlain, T. W., Griffiths, A., Collins, S. M., Wu, K., Simmons, M. D., Bourne, R. A., Lovelock, K. R. J. ORCID: https://orcid.org/0000-0003-1431-269X and Seymour, J. (2022) Efficient hydrolytic hydrogen evolution from sodium borohydride catalyzed by polymer immobilized ionic liquid‐stabilized platinum nanoparticles. ChemCatChem, 14 (4). e202101752. ISSN 1867-3899 doi: 10.1002/cctc.202101752

Freer, R., Ekren, D., Ghosh, T., Biswas, K., Qiu, P., Wan, S., Chen, L., Han, S., Fu, C., Zhu, T., Shawon, A. K. M. A., Zevalkink, A., Imasato, K., Snyder, G. J., Ozen, M., Saglik, K., Aydemir, U., Cardoso-Gil, R., Svanidze, E., Funahashi, R., Powell, A. V., Mukherjee, S., Tippireddy, S., Vaqueiro, P. ORCID: https://orcid.org/0000-0001-7545-6262, Gascoin, F., Kyratsi, T., Sauerschnig, P. and Mori, T. (2022) Key properties of inorganic thermoelectric materials – tables (version 1). Journal of Physics: Energy, 4 (2). 022002. ISSN 2515-7655 doi: 10.1088/2515-7655/ac49dc

Gavriel, A. G., Sambrook, M. R., Russell, A. T. and Hayes, W. ORCID: https://orcid.org/0000-0003-0047-2991 (2022) Recent advances in self-immolative linkers and their applications in polymeric reporting systems. Polymer Chemistry, 13 (22). pp. 3188-3269. ISSN 1759-9954 doi: 10.1039/D2PY00414C

Gerbelli, B. B., Filho, P. L. O., Cortez, B., Sodré, P. T., Coutinho-Neto, M. D., Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926, Seitsonen, J. and Alves, W. A. (2022) Interaction between glyphosate pesticide and amphiphilic peptides for colorimetric analysis. Nanoscale Advances, 4 (17). pp. 3592-3599. ISSN 2516-0230 doi: 10.1039/D2NA00345G

Gousseva, E., Midgley, S. D., Seymour, J. M., Seidel, R. ORCID: https://orcid.org/0000-0003-2613-4106, Grau-Crespo, R. ORCID: https://orcid.org/0000-0001-8845-1719 and Lovelock, K. R. J. ORCID: https://orcid.org/0000-0003-1431-269X (2022) Understanding X-ray photoelectron spectra of ionic liquids: experiments and simulations of 1-butyl-3-methylimidazolium thiocyanate. Journal of Physical Chemistry B, 126 (49). pp. 10500-10509. ISSN 1520-6106 doi: 10.1021/acs.jpcb.2c06372

Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926 (2022) Diffuse scattering from lamellar structures. Soft Matter, 18 (4). pp. 711-721. ISSN 1744-683X doi: 10.1039/D1SM01758F

Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926 (2022) Peptides for vaccine development. ACS Applied Bio Materials, 5 (3). pp. 905-944. ISSN 2576-6422 doi: 10.1021/acsabm.1c01238

Hu, Y. X., Deng, Q., Ou, Y.-P., Yang, X., Zhang, J., Garrett, E. K. ORCID: https://orcid.org/0000-0002-5360-7645, Zhu, J. ORCID: https://orcid.org/0000-0002-2099-3156, Liu, S. H. ORCID: https://orcid.org/0000-0002-0784-6418 and Hartl, F. ORCID: https://orcid.org/0000-0002-7013-5360 (2022) A conjugated diosma-octacyclic complex and its mixed-valence singly reduced state. Inorganic Chemistry Frontiers, 9 (22). pp. 5893-5902. ISSN 2052-1553 doi: 10.1039/d2qi01523d

Hyder, M., O'Donnell, A. D., Chippindale, A. M. ORCID: https://orcid.org/0000-0002-5918-8701, German, I. M., Harries, J. L., Shebanova, O., Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926 and Hayes, W. ORCID: https://orcid.org/0000-0003-0047-2991 (2022) Tailoring viscoelastic properties of dynamic supramolecular poly(butadiene)-based elastomers. Materials Today Chemistry, 26. 101008. ISSN 2468-5194 doi: 10.1016/j.mtchem.2022.101008

Knight, K. S., Gibbs, A. S., Bull, C. L., Powell, A. V., Funnell, N. P. and Ridley, C. J. (2022) Low-intermediate-temperature, high-pressure thermoelastic and crystallographic properties of thermoelectric clausthalite (PbSe-I). Materials Advances, 3 (4). pp. 2077-2088. ISSN ISSN 2633-5409 doi: 10.1039/D1MA01093J

Krenkel, H., Brown, J., Richardson, K., Hoyes, E., Morris, M. and Cramer, R. ORCID: https://orcid.org/0000-0002-8037-2511 (2022) Ultrahigh-throughput sample analysis using liquid atmospheric pressure matrix-assisted laser desorption/ionization mass spectrometry. Analytical Chemistry, 94 (10). pp. 4141-4145. ISSN 0003-2700 doi: 10.1021/acs.analchem.1c05614

Large, A. I., Bennett, R. A. ORCID: https://orcid.org/0000-0001-6266-3510, Eralp-Erden, T. and Held, G. (2022) In situ surface analysis of palladium-platinum alloys in methane oxidation conditions. Faraday Discussions, 236. pp. 157-177. ISSN 1364-5498 doi: 10.1039/D1FD00113B

Liu, W., Das, P. J., Colquhoun, H. M. and Stoddart, J. F. (2022) Whither second-sphere coordination? CCS Chemistry, 4 (3). pp. 755-784. ISSN 2096-5745 doi: 10.31635/ccschem.021.202101286

Maji, K., Lemoine, P., Renaud, A., Zhang, B., Zhou, X., Carnevali, V., Candolfi, C., Raveau, B., Al Orabi, R. A. R., Fornari, M., Vaqueiro, P. ORCID: https://orcid.org/0000-0001-7545-6262, Pasturel, M., Prestipino, C. and Guilmeau, E. (2022) A tunable structural family with ultralow thermal conductivity: copper deficient Cu1-x□xPb1-xBi1+xS3. Journal of the American Chemical Society, 144 (4). pp. 1846-1860. ISSN 0002-7863 doi: 10.1021/jacs.1c11998

McQuaid, K. T. ORCID: https://orcid.org/0000-0002-3222-5584, Pipier, A., Cardin, C. J. ORCID: https://orcid.org/0000-0002-2556-9995 and Monchaud, D. ORCID: https://orcid.org/0000-0002-3056-9295 (2022) Interactions of small molecules with DNA junctions. Nucleic Acids Research, 50 (22). pp. 12636-12656. ISSN 1362-4962 doi: 10.1093/nar/gkac1043

McQuaid, K. T. ORCID: https://orcid.org/0000-0002-3222-5584, Takahashi, S., Baumgaertner, L., Cardin, D. J., Paterson, N. G., Hall, J. P. ORCID: https://orcid.org/0000-0003-3716-4378, Sugimoto, N. and Cardin, C. J. ORCID: https://orcid.org/0000-0002-2556-9995 (2022) Ruthenium polypyridyl complex bound to a unimolecular chair-form G-quadruplex. Journal of the American Chemical Society, 144 (13). pp. 5956-5964. ISSN 0002-7863 doi: 10.1021/jacs.2c00178

Menendez-Proupin, E., Grover, S., Montero-Alejo, A. L., Midgley, S. D., Butler, K. T. and Grau-Crespo, R. ORCID: https://orcid.org/0000-0001-8845-1719 (2022) Mixed-anion mixed-cation perovskite (FAPbI3)0.875(MAPbBr3)0.125: an ab initio molecular dynamics study. Journal of Materials Chemistry A, 10 (17). pp. 9592-9603. ISSN 0959-9428 doi: 10.1039/D1TA10860C

Midgley, S. D., Fleitmann, D. and Grau-Crespo, R. ORCID: https://orcid.org/0000-0001-8845-1719 (2022) Bromate incorporation in calcite and aragonite. Geochimica Et Cosmochimica Acta, 324. pp. 17-25. ISSN 0016-7037 doi: 10.1016/j.gca.2022.02.028

Mondal, B., Gupta, V. K., Hansda, B., Bhoumik, A., Mondal, T., Majumder, H. K., Edwards-Gayle, C. J. C., Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926, Jaisankar, P. and Banerjee, A. (2022) Amino acid containing amphiphilic hydrogelators with antibacterial and antiparasitic activities. Soft Matter, 18 (37). pp. 7201-7216. ISSN 1744-683X doi: 10.1039/D2SM00562J

Mukherjee, S., Powell, A. V., Voneshen, D. J. and Vaqueiro, P. ORCID: https://orcid.org/0000-0001-7545-6262 (2022) Talnakhite: a potential n-type thermoelectric sulphide with low thermal conductivity. Journal of Solid State Chemistry, 314. 123425. ISSN 0022-4596 doi: 10.1016/j.jssc.2022.123425

O'Donnell, A. D., Salimi, S., Hart, L. R., Babra, T. S., Greenland, B. W. and Hayes, W. ORCID: https://orcid.org/0000-0003-0047-2991 (2022) Applications of supramolecular polymer networks. Reactive and Functional Polymers, 172. 105209. ISSN 1381-5148 doi: 10.1016/j.reactfunctpolym.2022.105209

Orton, G. R. F., Ghosh, S., Alker, L., Sarker, J. C., Pugh, D., Richmond, M. G., Hartl, F. ORCID: https://orcid.org/0000-0002-7013-5360 and Hogarth, G. (2022) Biomimics of [FeFe]-hydrogenases incorporating redox-active ligands: synthesis, redox properties and spectroelectrochemistry of diiron-dithiolate complexes with ferrocenyl-diphosphines as Fe4S4 surrogates. Dalton Transactions, 51 (25). pp. 9748-9769. ISSN 1364-5447 doi: 10.1039/d2dt00419d

Piras, C., Hale, O. J., Reynolds, C. K. ORCID: https://orcid.org/0000-0002-4152-1190, Jones, A. K. (B.), Taylor, N., Morris, M. and Cramer, R. ORCID: https://orcid.org/0000-0002-8037-2511 (2022) LAP-MALDI MS coupled with machine learning: an ambient mass spectrometry approach for high-throughput diagnostics. Chemical Science, 13 (6). pp. 1746-1758. ISSN 1478-6524 doi: 10.1039/D1SC05171G

Plata, J. J., Posligua, V., Marquez, A. M., Sanz, J. F. and Grau-Crespo, R. ORCID: https://orcid.org/0000-0001-8845-1719 (2022) Charting the lattice thermal conductivities of I-III-VI2 chalcopyrite semiconductors. Chemistry of Materials, 34 (6). pp. 2833-2841. ISSN 1520-5002 doi: 10.1021/acs.chemmater.2c00336

Sanchez-Palencia, P., Hamad, S., Palacios, P., Grau-Crespo, R. ORCID: https://orcid.org/0000-0001-8845-1719 and Butler, K. T. (2022) Spinel nitride solid solutions: charting properties in the configurational space with explainable machine learning. Digital Discovery, 1 (5). pp. 665-678. ISSN 2635-098X doi: 10.1039/D2DD00038E

Tippireddy, S., Azough, F., Vikram, V., Towers Tompkins, F., Bhui, A., Freer, R., Grau-Crespo, R. ORCID: https://orcid.org/0000-0001-8845-1719, Biswas, K., Vaqueiro, P. ORCID: https://orcid.org/0000-0001-7545-6262 and Powell, A. V. (2022) Tin-substituted chalcopyrite: an n-type sulfide with enhanced thermoelectric performance. Chemistry of Materials, 34 (13). pp. 5860-5873. ISSN 1520-5002 doi: 10.1021/acs.chemmater.2c00637

Tippireddy, S., azough, F., Vikram, V., Bhui, A., Chater, P., Kepaptsoglou, D., Ramasse, Q., Freer, R., Grau-Crespo, R. ORCID: https://orcid.org/0000-0001-8845-1719, Biswas, K., Vaqueiro, P. ORCID: https://orcid.org/0000-0001-7545-6262 and Powell, A. V. (2022) Local structural distortions and reduced thermal conductivity in Ge-Substituted Chalcopyrite. Journal of Materials Chemistry A, 10 (44). pp. 23874-23885. ISSN 0959-9428 doi: 10.1039/D2TA06443J

Trunks, T. M., Babra, J. S., Westwood, J. and Smith, C. D. ORCID: https://orcid.org/0000-0002-5911-5836 (2022) A homocoupling approach to the key dione of CyMe4-BTPhen – vital ligands for nuclear clean-up by the SANEX process. SynOpen, 6 (1). pp. 16-18. ISSN 2509-9396 doi: 10.1055/a-1737-8610

de Mello, L. R., Carrascosa, V., Rebelato, E., Juliano, M. A., Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926, Castelletto, V. ORCID: https://orcid.org/0000-0002-3705-0162, Vassiliades, S. V. ORCID: https://orcid.org/0000-0002-4328-9284, Alves, W. A. ORCID: https://orcid.org/0000-0002-8394-2751, Nakaie, C. R. and da Silva, E. R. ORCID: https://orcid.org/0000-0001-5876-2276 (2022) Nanostructure formation and cell spheroid morphogenesis of a peptide supramolecular hydrogel. Langmuir, 38 (11). pp. 3434-3445. ISSN 0743-7463 doi: 10.1021/acs.langmuir.1c03215

Book or Report Section

Antunes, L. M., Vikram, V., Plata, J. J., Powell, A. V., Butler, K. T. and Grau-Crespo, R. ORCID: https://orcid.org/0000-0001-8845-1719 (2022) Machine learning approaches for accelerating the discovery of thermoelectric materials. In: An, Y. (ed.) Machine Learning in Materials Informatics: Methods and Applications. American Chemical Society, Washington, DC, pp. 1-32. ISBN 9780841297630 doi: 10.1021/bk-2022-1416.ch001

Tippireddy, S., Powell, A. V. and Wong, T. K. S. (2022) High-performance low-cost sulfide/selenide thermoelectric devices. In: Dalapati, G., Wong, T. S., Kundu, S., Chraborty, A. and Zhuk, S. (eds.) Sulfide and Selenide Based Materials for Emerging Applications: Sustainable Energy Harvesting and Storage Technology. Elsevier, Amsterdam, pp. 329-375. ISBN 9780323998604 doi: 10.1016/B978-0-323-99860-4.00014-9

Vaqueiro, P. ORCID: https://orcid.org/0000-0001-7545-6262 (2022) Synthesis and property measurements of thermoelectric materials. In: Powell, A. V. (ed.) Inorganic Thermoelectric Materials: From Fundamental Concepts to Materials Design. Inorganic Materials Series (9). Royal Society of Chemistry, Cambridge, pp. 1-52. ISBN 9781788017596 doi: 10.1039/9781788019590

Conference or Workshop Item

Reeves, S. J., Davis, F. J. ORCID: https://orcid.org/0000-0003-0462-872X and Mitchell, G. R. (2022) Ferronematic liquid crystal polymers and elastomers. In: MATERIALS 2022. doi: 10.3390/materproc2022008135

Book

Powell, A. V. (2022) Inorganic Thermoelectric Materials. Inorganic Materials. Royal Society of Chemistry. ISBN 9781788019606 doi: 10.1039/9781788019590

Thesis

Gavriel, A. (2022) Self-immolative entities for the enhanced disclosure of electrophilic species. PhD thesis, University of Reading. doi: 10.48683/1926.00117013

Grover, S. (2022) First-principles modelling of functional perovskites. PhD thesis, University of Reading. doi: 10.48683/1926.00113103

O'Donnell, A. D. (2022) Bis aromatic urea hydrogen bonding motifs for use in supramolecular materials. PhD thesis, University of Reading. doi: 10.48683/1926.00120134

Salimi, S. (2022) Property enhancement of supramolecular polymers for 3D printing. PhD thesis, University of Reading. doi: 10.48683/1926.00116541

Seymour, J. M. (2022) An investigation of the electronic structure of ions in the liquid phase using x-ray spectroscopic techniques. PhD thesis, University of Reading. doi: 10.48683/1926.00113104

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