Journal Article

Aarons, Jolyon, Verga, L. G., Hine, Nicholas and Skylaris, C-K. (2019) Atom-projected and angular momentum resolved density of states in the ONETEP code. Electronic Structure, 1 (3). 035002. doi:10.1088/2516-1075/ab34f5

Aaronson, Barak D. B., Byers, Joshua C., Colburn, Alex W., McKelvey, Kim M. (Kim Martin) and Unwin, Patrick R. (2015) Scanning electrochemical cell microscopy platform for ultrasensitive photoelectrochemical imaging. Analytical Chemistry, 87 (8). pp. 4129-4133. doi:10.1021/acs.analchem.5b00288

Aaronson, Barak D. B., Chen, Chang-Hui, Li, Hongjiao, Koper, Marc T. M., Lai, Stanley Chi Shing and Unwin, Patrick R. (2013) Pseudo-single crystal electrochemistry on polycrystalline electrodes : visualizing activity at grains and grain boundaries on platinum for the Fe2+/Fe3+ redox reaction. Journal of the American Chemical Society, Volume 135 (Number 10). pp. 3873-3880. doi:10.1021/ja310632k

Aaronson, Barak D. B., Lai, Stanley Chi Shing and Unwin, Patrick R. (2014) Spatially resolved electrochemistry in ionic liquids : surface structure effects on triiodide reduction at platinum electrodes. Langmuir, Volume 30 (Number 7). pp. 1915-1919. doi:10.1021/la500271f

Abbas, Syeda, Kelly, Nicole L., Patias, Georgios, Hanna, John V. and McNally, Tony (2020) Cysteamine functionalised reduced graphene oxide modification of maleated poly(propylene). Polymer, 203 . 122750. doi:10.1016/j.polymer.2020.122750

Abbas, Syeda, Rees, Gregory J., Kelly, Nicole L., Dancer, Claire E. J., Hanna, John V. and McNally, Tony (2018) Facile silane functionalization of graphene oxide. Nanoscale, 10 (34). 16231-16242 . doi:10.1039/C8NR04781B

Abiev, Rufat Sh., Sladkovskiy, Dmitry A., Semikin, Kirill V., Murzin, Dmitry Yu. and Rebrov, Evgeny V. (2020) Non-thermal plasma for process and energy intensification in dry reforming of methane. Catalysts, 10 (11). e1358. doi:10.3390/catal10111358

Abiola, Temitope T., Rodrigues, Natércia D. N., Ho, Casey, Coxon, Daniel J. L., Horbury, Michael D., Toldo, Josene M., do Casal, Mariana T., Rioux, Benjamin, Peyrot, Cédric, Mention, Matthieu M., Balaguer, Patrick, Barbatti, Mario, Allais, Florent and Stavros, Vasilios G. (2021) New generation UV-A filters : understanding their photodynamics on a human skin mimic. The Journal of Physical Chemistry Letters, 12 . pp. 337-344. doi:10.1021/acs.jpclett.0c03004

Ablitt, Chris, Mostofi, Arash A., Bristowe, Nicholas C. and Senn, Mark S. (2018) Control of uniaxial negative thermal expansion in layered perovskites by tuning layer thickness. Frontiers in Chemistry, 6 . 455. doi:10.3389/fchem.2018.00455

Abou Neel, Ensanya A., Chrzanowski, Wojciech, Valappil, Sabeel P., O'Dell, L. A., Pickup, David M., Smith, Mark E., Newport, Robert J. and Knowles, Jonathan C. (2009) Doping of a high calcium oxide metaphosphate glass with titanium dioxide. Journal of Non-Crystalline Solids, Vol.355 (No.16-17). pp. 991-1000. doi:10.1016/j.jnoncrysol.2009.04.016

Abrams, William R., Madsen, Jens, Gaiha, Gaurav D., Palaniyar, Nades, Dong, Tao, Mitchell, Daniel A. and Clark, Howard W. (2013) Surfactant protein D modulates HIV infection of both T-cells and dendritic cells. PLoS One, Volume 8 (Number 3). Article no. e59047. doi:10.1371/journal.pone.0059047

Abuhammad, Areej, Fullam, Elizabeth, Bhakta, Sanjib, Russell, Angela, Morris, Garrett, Finn, Paul and Sim, Edith (2014) Exploration of piperidinols as potential antitubercular agents. Molecules, Volume 19 (Number 10). pp. 16274-16290. doi:10.3390/molecules191016274

Adobes Vidal, Maria, Maddar, Faduma, Momotenko, Dmitry, Hughes, Leslie P., Wren, Stephen A. C., Poloni, Laura N., Ward, Michael D. and Unwin, Patrick R. (2016) Face-discriminating dissolution kinetics of furosemide single crystals : in situ three-dimensional multi-microscopy and modeling. Crystal Growth & Design, 16 (8). pp. 4421-4429. doi:10.1021/acs.cgd.6b00543

Agustika, Dyah, Mercuriani, Ixora S., Ariyanti, Nur Aeni, Purnomo, Chandra W., Triyana, Kuwat, Iliescu, Daciana and Leeson, Mark S. (2021) Gas chromatography-mass spectrometry analysis of compounds emitted by pepper yellow leaf curl virus-infected chili plants : a preliminary study. Separations, 8 (9). 136. doi:10.3390/separations8090136

Al-Amin, Mohammad, Grant, Nicholas E., Pointon, A. I. and Murphy, J. D. (2019) Iodine-ethanol surface passivation for measurement of millisecond carrier lifetimes in silicon wafers with different crystallographic orientations. Physica Status Solidi A, 216 (17). 1900257. doi:10.1002/pssa.201900257

Al-Amin, Mohammad and Murphy, John D. (2017) Combining low-temperature gettering with phosphorus diffusion gettering for improved multicrystalline silicon. IEEE Journal of Photovoltaics, 7 (6). 1519 -1527. doi:10.1109/JPHOTOV.2017.2741100

Alberti, Fabrizio, Leng, Daniel J., Wilkening, Ina, Song, Lijiang, Tosin, Manuela and Corre, Christophe (2019) Triggering the expression of a silent gene cluster from genetically intractable bacteria results in scleric acid discovery. Chemical Science, 10 (2). pp. 453-463. doi:10.1039/C8SC03814G

Alborzpour, Jonathan, Tew, David P. and Habershon, Scott (2016) Efficient and accurate evaluation of potential energy matrix elements for quantum dynamics using Gaussian process regression. Journal of Chemical Physics, 145 (17). 174112. doi:10.1063/1.4964902

Aldegunde, Manuel, Kermode, James R. and Zabaras , Nicholas (2016) Development of an exchange–correlation functional with uncertainty quantification capabilities for density functional theory. Journal of Computational Physics, 311 . pp. 173-195. doi:10.1016/j.jcp.2016.01.034

Alguel, Y., Cameron, Alexander, Diallinas, G. and Byrne, B. (2016) Transporter oligomerization : form and function. Biochemical Society Transactions, 44 (6). pp. 1737-1744. doi:10.1042/BST20160217

Aljuaid, Mohammed, Liarou, Evelina, Town, James, Baker, James R., Haddleton, David M. and Wilson, Paul (2020) Synthesis and [2+2]-photodimerisation of monothiomaleimide functionalised linear and brush-like polymers. Chemical Communications, 56 (66). pp. 9545-9548. doi:10.1039/D0CC04067C

Alkhalaf, Lona M., Barry, Sarah M., Rea, Dean, Gallo, Angelo, Griffiths, Daniel, Lewandowski, Józef R., Fülöp, Vilmos and Challis, Gregory L. (2019) Binding of distinct substrate conformations enables hydroxylation of remote sties in thaxtomin D by cytochrome P450 TxtC. Journal of the American Chemical Society, 141 (1). pp. 216-222. doi:10.1021/jacs.8b08864

Allen, M. P. and Humpert, Anja (2015) Propagating director bend fluctuations in nematic liquid crystals. Physical Review Letters, 114 (2). 028301. doi:10.1103/PhysRevLett.114.028301

Allen, M. P., Quigley, David and Růžička, Štěpán (2012) Folding kinetics of a polymer. Physical Chemistry Chemical Physics, Volume 2012 (Number 14). pp. 6044-6053. doi:10.1039/c2cp00051b

Allen, Stuart C. H., Moore, Katherine A. H., Marsden, Catherine J., Fülöp, Vilmos, Moffat, Kevin G., Lord, Mike, Ladds, Graham and Roberts, L. M. (Lynne M.) (2007) The isolation and characterisation of temperature-dependent Ricin A chain molecules in Saccharomyces cerevisiae. FEBS Journal, Vol.274 (No.21). pp. 5586-5599. doi:10.1111/j.1742-4658.2007.06080.x

Alobaid, Meshal A., Richards, Sarah-Jane, Alexander, Morgan R., Gibson, Matthew I. and Ghaemmaghami, Amir M. (2020) Developing immune-regulatory materials using immobilized monosaccharides with immune-instructive properties. Materials Today Bio, 8 . 100080. doi:10.1016/j.mtbio.2020.100080

Alsubaie, Fehaid, Liarou, Evelina, Nikolaou, Vasiliki, Wilson, Paul and Haddleton, David M. (2019) Thermoresponsive viscosity of polyacrylamide block copolymers synthesised via aqueous Cu-RDRP. European Polymer Journal, 114 . pp. 326-331. doi:10.1016/j.eurpolymj.2019.02.045

Alzahrani, Khalid and Deeth, Robert J. (2016) Density functional calculations reveal a flexible version of the copper paddlewheel unit : implications for metal organic frameworks. Dalton Transactions, 45 . pp. 11944-11948. doi:10.1039/c6dt01474g

Alzahrani, Khalid and Deeth, Robert J. (2016) Molecular modeling of zinc paddlewheel molecular complexes and the pores of a flexible metal organic framework. Journal of Molecular Modeling, 22 (4). 80. doi:10.1007/s00894-016-2949-5

Amar, Ibrahim A., Lan, Rong, Humphreys, John and Tao, Shanwen (2017) Electrochemical synthesis of ammonia from wet nitrogen via a dual-chamber reactor using La0.6Sr0.4Co0.2Fe0.8O3 − δCe0.8Gd0.18Ca0.02O2 − δ composite cathode. Catalysis Today, 286 . pp. 51-56. doi:10.1016/j.cattod.2016.09.006

Ambrosio, Francesco and Troisi, Alessandro (2014) Singlet fission in linear chains of molecules. The Journal of Chemical Physics, 141 (20). 204703. doi:10.1063/1.4902135

Amel, Hoda, Rongong, Jem, Moztarzadeh, Hadi and Hopkinson, Neil (2016) Effect of section thickness on fatigue performance of laser sintered Nylon 12. Polymer Testing, 53 . pp. 204-210. doi:10.1016/j.polymertesting.2016.05.027

Amietszajew, Tazdin, Sridhar, Seetharaman and Bhagat, Rohit (2016) Metal recovery by electrodeposition from a molten salt two-phase cell system. Journal of The Electrochemical Society, 163 (9). D515-D521. doi:10.1149/2.0991609jes

Amietszajew, Tazdin, Sridhar, Seetharaman and Bhagat, Rohit (2015) The solubility of specific metal oxides in molten borate glass. Journal of the American Ceramic Society, 98 (10). pp. 2984-2987. doi:10.1111/jace.13801

Amin, Mohammad A., Camerino, Michelle A., Mountford, Simon J., Ma, Xiao, Manallack, David T., Chalmers, David K., Wills, Martin and Thompson, Philip E. (2019) (S)-(−)-Fluorenylethylchloroformate (FLEC) ; preparation using asymmetric transfer hydrogenation and application to the analysis and resolution of amines. Tetrahedron, 75 (43). 130591. doi:10.1016/j.tet.2019.130591

Amin, Munia, Porter, Steven L. and Soyer, Orkun S. (2013) Split histidine kinases enable ultrasensitivity and bistability in two-component signaling networks. PLoS Computational Biology, Volume 9 (Number 3). Article no. e1002949. doi:10.1371/journal.pcbi.1002949

Anderson, Zoe J. and Fox, David J. (2015) Total synthesis of the azolemycins. Organic and Biomolecular Chemistry, 2016 (4). pp. 1450-1454.

Anderson, Zoe J., Hobson, Christian, Needley, Rebecca, Song, Lijiang, Perryman, Michael S., Kerby, Paul D. and Fox, David J. (2017) NMR-based assignment of isoleucine vs allo-isoleucine stereochemistry. Organic & Biomolecular Chemistry, 15 (44). 9372-9378 . doi:10.1039/C7OB01995E

Andrew, Rhiann and Chaplin, Adrian B. (2014) Synthesis, structure and dynamics of NHC-based palladium macrocycles. Dalton Transactions, Volume 43 (Number). pp. 1413-1423. doi:10.1039/c3dt52578c

Andrew, Rhiann, Storey, Caroline M. and Chaplin, Adrian B. (2016) Well-defined coinage metal transfer agents for the synthesis of NHC-based nickel, rhodium and palladium macrocycles. Dalton Transactions, 45 (21). pp. 8937-8944. doi:10.1039/c6dt01263a

Annis, James W., Fisher, Janet M., Thompsett, David and Walton, Richard I. (2021) Solvothermal synthesis routes to substituted cerium dioxide materials. Inorganics, 9 (6). e40. doi:10.3390/inorganics9060040

Ansari, N., Dandekar, R., Caravati, S., Sosso, Gabriele C. and Hassanali, A. (2018) High and low density patches in simulated liquid water. The Journal of Chemical Physics, 149 (20). 204507. doi:10.1063/1.5053559

Apps, Samantha L., Alflatt, Rhiannon E., Leforestier, Baptiste, Storey, Caroline M. and Chaplin, Adrian B. (2018) Divergent stereoisomers of molybdenum carbonyl complexes of NHC-based pincer ligands. Polyhedron, 143 . pp. 57-61. doi:10.1016/j.poly.2017.08.001

Aragó, Juan and Troisi, Alessandro (2016) Regimes of exciton transport in molecular crystals in the presence of dynamic disorder. Advanced Functional Materials, 26 (14). pp. 2316-2325. doi:10.1002/adfm.201503888

Argent, Stephen P., Jackson, Fiona C., Chan, Ho Man, Meyrick, Sam, Taylor, Christopher G. P., Ronson, Tanya K., Rourke, Jonathan P. and Ward, Michael D. (2020) A family of diastereomeric dodecanuclear coordination cages based on inversion of chirality of individual triangular cyclic helicate faces. Chemical Science, 11 (37). pp. 10167-10174. doi:10.1039/d0sc04347h

Arter, William E., Charmet, Jérôme, Kong, Jinglin, Saar, Kadi L., Herling, Therese W., Müller, Thomas, Keyser, Ulrich F. and Knowles, Tuomas P. J. (2018) Combining affinity selection and specific ion mobility for microchip protein sensing. Analytical Chemistry, 90 (17). pp. 10302-10310. doi:10.1021/acs.analchem.8b02051

Atkins, Christophe J., Patias, Georgios, Town, James, Wemyss, Alan M., Eissa, Ahmed M., Shegiwal, Ataulla and Haddleton, David M. (2019) A simple and versatile route to amphiphilic polymethacrylates : catalytic chain transfer polymerisation (CCTP) coupled with post-polymerisation modifications. Polymer Chemistry, 10 (5). pp. 646-655. doi:10.1039/C8PY01641K

Atkins, Christophe J., Seow, David, Burns, Gerard, Town, James, Hand, Rachel A., Lester, Daniel, Cameron, Neil R., Haddleton, David M. and Eissa, Ahmed M. (2020) Branched macromonomers from catalytic chain transfer polymerisation (CCTP) as precursors for emulsion-templated porous polymers. Polymer Chemistry, 11 (23). pp. 3841-3848. doi:10.1039/d0py00539h

Auinger, Michael, Praig, Vera G., Linder, Bernhard and Danninger, H. (Herbert) (2015) Grain boundary oxidation in iron-based alloys, investigated by 18O enriched water vapour : the effect of mixed oxides in binary and ternary Fe-{Al, Cr, Mn, Si} systems. Corrosion Science, 96 . pp. 133-143. doi:10.1016/j.corsci.2015.04.009

Avraam, Philip W., Hine, Nicholas, Tangney, Paul and Haynes, Peter D. (2011) Factors influencing the distribution of charge in polar nanocrystals. Physical Review B (Condensed Matter and Materials Physics), 83 (24). pp. 1-5. 241402(R) . doi:10.1103/PhysRevB.83.241402

Avraam, Philip W., Hine, Nicholas, Tangney, Paul and Haynes, Peter D. (2012) Fermi-level pinning can determine polarity in semiconductor nanorods. Physical Review B (Condensed Matter and Materials Physics), 85 (11). pp. 1-9. 115404 . doi:10.1103/PhysRevB.85.115404

Awasthi, Shalini, Gupta, Shalini, Tripathi, Ravi and Nair, Nisanth N. (2018) Mechanism and kinetics of Aztreonam hydrolysis catalyzed by class-C β-lactamase : a temperature-accelerated sliced sampling study. The Journal of Physical Chemistry B, 122 (15). pp. 4299-4308. doi:10.1021/acs.jpcb.8b01287

Awasthi, Shalini, Kapil, Venkat and Nair, Nisanth N. (2016) Sampling free energy surfaces as slices by combining umbrella sampling and metadynamics. Journal of Computational Chemistry, 37 (16). pp. 1413-1424. doi:10.1002/jcc.24349

Awasthi, Shalini and Nair, Nisanth N. (2017) Exploring high dimensional free energy landscapes : temperature accelerated sliced sampling. The Journal of Chemical Physics, 146 (9). 094108. doi:10.1063/1.4977704

Awasthi, Shalini and Nair, Nisanth N. (2019) Exploring high-dimensional free energy landscapes of chemical reactions. Wiley Interdisciplinary Reviews : Computational Molecular Science, 9 (3). e1398. doi:10.1002/wcms.1398

Bachtiger, Fabienne, Congdon, Thomas R., Stubbs, Christopher D., Gibson, Matthew I. and Sosso, Gabriele C. (2021) The atomistic details of the ice recrystallisation inhibition activity of PVA. Nature Communications, 12 (1). 1323. doi:10.1038/s41467-021-21717-z (In Press)

Bai, Chenyao, Leeson, Mark S. and Higgins, Matthew D. (2014) Minimum energy channel codes for molecular communications. Electronics Letters, 50 (23). pp. 1669-1671. doi:10.1049/el.2014.3345

Bai, Chenyao, Leeson, Mark S. and Higgins, Matthew D. (2015) Performance of SW-ARQ in bacterial quorum communications. Nano Communication Networks, Volume 6 (Number 1). pp. 3-14. doi:10.1016/j.nancom.2014.11.001

Bailey, Trisha L., Stubbs, Christopher D., Murray, Kathryn, Tomás, Ruben M. F., Otten, Lucienne and Gibson, Matthew I. (2019) Synthetically scalable poly(ampholyte) which dramatically enhances cellular cryopreservation. Biomacromolecules, 20 (8). pp. 3104-3114. doi:10.1021/acs.biomac.9b00681

Baker, Lewis A., Clark, Sarah L., Habershon, Scott and Stavros, Vasilios G. (2017) Ultrafast transient absorption spectroscopy of the sunscreen constituent ethylhexyl triazone. The Journal of Physical Chemistry Letters, 8 (10). pp. 2113-2118. doi:10.1021/acs.jpclett.7b00633

Baker, Lewis A., Greenough, Simon E. and Stavros, Vasilios G. (2016) A perspective on the ultrafast photochemistry of solution-phase sunscreen molecules. The Journal of Physical Chemistry Letters, 7 (22). pp. 4655-4665. doi:10.1021/acs.jpclett.6b02104

Baker, Lewis A., Grosvenor, Lucy C., Ashfold, M. N. R. and Stavros, Vasilios G. (2016) Ultrafast photophysical studies of a multicomponent sunscreen : oxybenzone - titanium dioxide mixtures. Chemical Physics Letters, 664 . pp. 39-43.

Baker, Lewis A., Horbury, Michael D., Greenough, Simon E., Ashfold, Michael N. R. and Stavros, Vasilios G. (2015) Broadband ultrafast photoprotection by oxybenzone across the UVB and UVC spectral regions. Photochemical & Photobiological Sciences, 14 (10). pp. 1814-1820. doi:10.1039/C5PP00217F

Baker, Lewis A., Horbury, Michael D., Greenough, Simon E., Coulter, Philip M., Karsili, Tolga N. V., Roberts, Gareth M., Orr-Ewing, Andrew J., Ashfold, Michael N. R. and Stavros, Vasilios G. (2015) Probing the ultrafast energy dissipation mechanism of the sunscreen oxybenzone after UVA irradiation. Journal of Physical Chemistry Letters, 6 (8). pp. 1363-1368. doi:10.1021/acs.jpclett.5b00417

Baker, Lewis A. and Stavros, Vasilios G. (2016) Observing and understanding the ultrafast photochemistry in small molecules : applications to sunscreens. Science Progress, 9 (3). pp. 282-311. doi:10.3184/003685016X14684992086383

Bandi, Bharath, Santillana, Begona, Tiekink, Wouter, Koura, Nadia, Williams, Mark A. and Srirangam, Prakash (2020) 2D automated SEM and 3D X-ray computed tomography study on inclusion analysis of steels. Ironmaking & Steelmaking, 47 (1). pp. 47-50. doi:10.1080/03019233.2019.1652437

Banerjee, Samya, Capper, Miles S., Clarkson, Guy J., Huang, Huaiyi and Sadler, Peter J. (2019) Dual-action platinum(II) Schiff base complexes : photocytotoxicity and cellular imaging. Polyhedron, 172 . pp. 157-166. doi:10.1016/j.poly.2019.04.024

Banerjee, Samya, Omlor, Andreas, Wolny, Juliusz A., Han, Yisong, Lermyte, Frederik, Godfrey, Amy, O'Connor, Peter B., Schünemann, Volker, Danaie, Mohsen and Sadler, Peter J. (2019) Generation of maghemite nanocrystals from iron–sulfur centres. Dalton Transactions, 48 (26). pp. 9564-9569. doi:10.1039/C9DT00514E

Banks, Alice M., Song, Lijiang, Challis, Gregory L., Bailey, Andy M. and Foster, Gary D. (2020) Bovistol B, bovistol D and strossmayerin : Sesquiterpene metabolites from the culture filtrate of the basidiomycete Coprinopsis strossmayeri. PLoS One, 15 (4). e0229925. doi:10.1371/journal.pone.0229925

Bano , Anthony M., Rodger , P. Mark and Quigley, David (2014) New insight into the stability of CaCO3 surfaces and nanoparticles via molecular simulation. Langmuir, Volume 30 (Number 25). pp. 7513-7521. doi:10.1021/la501409j

Bao, Xianyang, Yu, Long, Simon, George P., Shen, Shirley, Xie, Fengwei, Liu, Hongsheng, Chen, Ling and Zhong, Lei (2018) Rheokinetics of graft copolymerization of acrylamide in concentrated starch and rheological behaviors and microstructures of reaction products. Carbohydrate Polymers, 192 . pp. 1-9. doi:10.1016/j.carbpol.2018.03.040

Barai, Anup, Uddin, Kotub, Widanage, Widanalage Dhammika, McGordon, Andrew and Jennings, P. A. (Paul A.) (2018) A study of the influence of measurement timescale on internal resistance characterisation methodologies for lithium-ion cells. Scientific Reports, 8 . 21. doi:10.1038/s41598-017-18424-5

T2K Collaboration (Including: Barker, Gary John, Boyd, Steve B., Hadley, David R., Haigh, J. T., Knight, A., Valder, S. and Vinning, W.). (2020) Simultaneous measurement of the muon neutrino charged-current cross section on oxygen and carbon without pions in the final state at T2K. Physical Review D (Particles, Fields, Gravitation and Cosmology), 101 (11). 112004. doi:10.1103/PhysRevD.101.112004

Barlow, Tammie R., Brendel, Johannes C. and Perrier, Sébastien (2016) Poly(bromoethyl acrylate) : a reactive precursor for the synthesis of functional RAFT materials. Macromolecules, 49 (17). pp. 6203-6212. doi:10.1021/acs.macromol.6b00721

Barnett, James P., Dr., Blindauer, Claudia A., Kassaar, Omar, Khazaipoul, Siavash, Martin, Esther M., Sadler, P. J. and Stewart, Alan J. S. (2013) Allosteric modulation of zinc speciation by fatty acids. Biochimica et Biophysica Acta (BBA) - General Subjects, Volume 830 (Number 12). doi:10.1016/j.bbagen.2013.05.028

Barney, Emma, Laorodphan, Nattapol, Mohd-Noor, Faizani, Holland, Diane, Kempton, Tom, Iuga, Dinu and Dupree, Ray (2020) Toward a structural model for the aluminum tellurite glass system. The Journal of Physical Chemistry C, 124 (37). pp. 20516-20529. doi:10.1021/acs.jpcc.0c04342

Barragán, Flavia, López-Senín, Paula, Salassa, Luca, Betanzos-Lara, Soledad, Habtemariam, Abraha, Moreno, Virtudes, Sadler, P. J. and Marchán, Vicente (2011) Photocontrolled DNA binding of a receptor-targeted organometallic ruthenium(II) complex. Journal of the American Chemical Society, Vol.133 (No.35). pp. 14098-14108. doi:10.1021/ja205235m

Barrios Antúnez, Diego-Javier, Greenhalgh, Mark D., Brueckner, Alexander C., Walden, Daniel M., Elías-Rodríguez, Pilar, Roberts, Patrick, Young, Benjamin G., West, Thomas H., Slawin, Alexandra M. Z., Ha-Yeon Cheong, Paul and Smith, Andrew D. (2019) Catalytic enantioselective synthesis of perfluoroalkyl-substituted β-lactones via a concerted asynchronous [2 + 2] cycloaddition : a synthetic and computational study. Chemical Science, 10 (24). pp. 6162-6173. doi:10.1039/C9SC00390H

Barrios-Rivera, Jonathan, Xu, Yingjian and Wills, Martin (2019) Applications of N′-monofunctionalised TsDPEN derivatives in asymmetric catalysis. Organic & Biomolecular Chemistry, 17 (6). pp. 1301-1321. doi:10.1039/C8OB02889C

Barrios-Rivera, Jonathan, Xu, Yingjian and Wills, Martin (2020) Asymmetric transfer hydrogenation of unhindered and non-electron-rich 1-Aryl dihydroisoquinolines with high enantioselectivity. Organic Letters, 22 (16). pp. 6283-6287. doi:10.1021/acs.orglett.0c02034

Barrios-Rivera, Jonathan, Xu, Yingjian and Wills, Martin (2019) Probing the effects of heterocyclic functionality in [(Benzene) Ru(TsDPENR) Cl] catalysts for asymmetric transfer hydrogenation. Organic Letters, 21 (18). pp. 7223-7227. doi:10.1021/acs.orglett.9b02339

Barrios-Rivera, Jonathan, Xu, Yingjian, Wills, Martin and Vyas, Vijyesh K. (2020) A diversity of recently reported methodology for asymmetric imine reduction. Organic Chemistry Frontiers, 7 (20). pp. 3312-3342. doi:10.1039/D0QO00794C

Barry, Nicolas P. E., Pitto-Barry, Anaïs, Sánchez, Ana M., Dove, Andrew P., Procter, Richard J., Soldevila-Barreda, Joan J., Kirby, Nigel, Hands-Portman, Ian, Smith, Corinne J., O'Reilly, Rachel K., Beanland, R. and Sadler, P. J. (2014) Fabrication of crystals from single metal atoms. Nature Communications, Volume 5 . Article number 3851 . doi:10.1038/ncomms4851

Barry, Nicolas P. E., Pitto-Barry, Anaïs, Tran, Johanna, Spencer, Simon E. F., Johansen, Adam M., Sanchez, Ana M., Dove, Andrew P., O’Reilly, Rachel K., Deeth, Robert J., Beanland, R. and Sadler, P. J. (2015) Osmium atoms and Os2 molecules move faster on selenium-doped compared to sulfur-doped boronic graphenic surfaces. Chemistry of Materials, 27 (14). pp. 5100-5105. doi:10.1021/acs.chemmater.5b01853

Barry, Nicolas P. E. and Sadler, P. J. (2012) Dicarba-closo-dodecarborane-containing half-sandwich complexes of ruthenium, osmium, rhodium and iridium : biological relevance and synthetic strategies. Chemical Society Reviews, Vol.41 (No.8). pp. 3264-3279. doi:10.1039/c2cs15300a

Bartok-Partay, Livia (2018) On the performance of interatomic potential models of iron : comparison of the phase diagrams. Computational Materials Science, 149 . pp. 153-157. doi:10.1016/j.commatsci.2018.03.026

Bartok-Partay, Livia, Csányi, Gábor and Bernstein, Noam (2021) Nested sampling for materials. The European Physical Journal B, 94 . 159. doi:10.1140/epjb/s10051-021-00172-1

Bartók, Albert P., Hantal, György and Pártay, Lívia B. (2021) Insight into liquid polymorphism from the complex phase behavior of a simple model. Physical Review Letters, 127 (1). doi:10.1103/PhysRevLett.127.015701

Bartók, Albert P., Kermode, James R., Bernstein, Noam and Csányi, Gábor (2018) Machine learning a general-purpose interatomic potential for silicon. Physical Review X, 8 (4). 041048 . doi:10.1103/PhysRevX.8.041048

Barua, Sourabh, Ciomaga Hatnean, Monica, Lees, Martin R. and Balakrishnan, Geetha (2017) Signatures of the Kondo effect in VSe2. Scientific Reports, 7 . 10964. doi:10.1038/s41598-017-11247-4

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