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研究领域

Next generation thin-film and quantum dot solar cells Hydrogen producing photocatalysts. Transparent conducting oxides Hybrid organic-inorganic semiconductor networks and interfaces. Lone pair containing oxides

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Azarhoosh, P., McKechnie, S., Frost, J. M., Walsh, A. and Van Schilfgaarde, M., 2016. Research Update:Relativistic origin of slow electron-hole recombination in hybrid halide perovskite solar cells. APL Materials, 4 (9), 091501. Hendon, C. H., Walsh, A. and Dinca, M., 2016. Frontier orbital engineering of metal-organic frameworks with extended inorganic connectivity:porous alkaline-earth oxides. Inorganic Chemistry, 55 (15), pp. 7265-7269. Kumagai, Y., Burton, L. A., Walsh, A. and Oba, F., 2016. Electronic structure and defect physics of tin sulfides:SnS, Sn2 S3, and Sn S2. Physical Review Applied, 6 (1), 014009. Wahila, M. J., Butler, K. T., Lebens-Higgins, Z. W., Hendon, C. H., Nandur, A. S., Treharne, R. E., Quackenbush, N. F., Sallis, S., Mason, K., Paik, H., Schlom, D. G., Woicik, J. C., Guo, J., Arena, D. A., White, B. E., Watson, G. W., Walsh, A. and Piper, L. F. J., 2016. Lone-pair stabilization in transparent amorphous tin oxides:a potential route to p-type conduction pathways. Chemistry of Materials, 28 (13), pp. 4706-4713. Shibuya, T., Skelton, J., Jackson, A., Yasuoka, K., Togo, A., Tanaka, I. and Walsh, A., 2016. Forthcoming. Suppression of lattice thermal conductivity by mass-conserving cation mutation in multi-component semiconductors. APL Materials, 4 (10), 104809. Bourdais, S., Choné, C., Delatouche, B., Jacob, A., Larramona, G., Moisan, C., Lafond, A., Donatini, F., Rey, G., Siebentritt, S., Walsh, A. and Dennler, G., 2016. Is the Cu/Zn disorder the main culprit for the voltage deficit in kesterite solar cells? Advanced Energy Materials, 6 (12). Hendon, C. H., Walsh, A., Akiyama, N., Konno, Y., Kajiwara, T., Ito, T., Kitagawa, H. and Sakai, K., 2016. One-dimensional Magnus-type platinum double salts. Nature Communications, 7, 11950. Leguy, A. M. A., Go?i, A. R., Frost, J. M., Skelton, J., Brivio, F., Rodríguez-Martínez, X., Weber, O. J., Pallipurath, A., Alonso, M. I., Campoy-Quiles, M., Weller, M. T., Nelson, J., Walsh, A. and Barnes, P. R. F., 2016. Dynamic disorder, phonon lifetimes, and the assignment of modes to the vibrational spectra of methylammonium lead halide perovskites. Physical Chemistry Chemical Physics Whittles, T. J., Burton, L. A., Skelton, J. M., Walsh, A., Veal, T. D. and Dhanak, V. R., 2016. Band alignments, valence bands, and core levels in the tin sulfides SnS, SnS2, and Sn2S3:Experiment and Theory. Chemistry of Materials, 28 (11), 3718–3726. Cruickshank, D. L., Hendon, C. H., Verbeek, M. J. R., Walsh, A. and Wilson, C. C., 2016. Polymorphism of the azobenzene dye compound methyl yellow. CrystEngComm, 18 (19), pp. 3456-3461. Bristow, J. and Walsh, A., 2016. Free Energy of Ligand Removal in the Metal-Organic Framework UiO-66. Journal of Physical Chemistry C, 120 (17), pp. 9276-9281. Ganose, A. M., Cuff, M., Butler, K. T., Walsh, A. and Scanlon, D. O., 2016. Interplay of orbital and relativistic effects in bismuth oxyhalides:BiOF, BiOCl, BiOBr, and BiOI. Chemistry of Materials, 28 (7), pp. 1980-1984. Caetano, C., Butler, K. T. and Walsh, A., 2016. Analysis of electrostatic stability and ordering in quaternary perovskite solid solutions. Physical Review B : Condensed Matter and Materials Physics, 93 (14), 144205. Nasalevich, M. A., Hendon, C. H., Santaclara, J. G., Svane, K., Van Der Linden, B., Veber, S. L., Fedin, M. V., Houtepen, A. J., Van Der Veen, M. A., Kapteijn, F., Walsh, A. and Gascon, J., 2016. Electronic origins of photocatalytic activity in d 0 metal organic frameworks. Scientific Reports, 6, 23676. Dimitrievska, M., Xie, H., Jackson, A. J., Fontané, X., Espindola-Rodriguez, M., Saucedo, E., Perez-Rodriguez, A., Walsh, A. and Izquierdo-Roca, V., 2016. Resonant Raman scattering of ZnSxSe1-x solid solutions:role of S and Se electronic states. Physical Chemistry Chemical Physics, 18 (11), pp. 7632-7640. Butler, K. T., Frost, J. M., Skelton, J. M., Svane, K. L. and Walsh, A., 2016. Computational materials design of crystalline solids. Chemical Society Reviews Brivio, F., Caetano, C. and Walsh, A., 2016. Thermodynamic origin of photoinstability in the CH3NH3Pb(I1-xBrx)3 hybrid halide perovskite alloy. Journal of Physical Chemistry Letters, 7 (6), pp. 1083-1087. Frost, J. M. and Walsh, A., 2016. What is moving in hybrid halide perovskite solar cells? Accounts of Chemical Research, 49 (3), pp. 528-535. Cadman, L. K., Bristow, J. K., Stubbs, N. E., Tiana, D., Mahon, M. F., Walsh, A. and Burrows, A. D., 2016. Compositional control of pore geometry in multivariate metal-organic frameworks:an experimental and computational study. Dalton Transactions, 45 (10), pp. 4316-4326. Butler, K. T., McKechnie, S., Azarhoosh, P., Van Schilfgaarde, M., Scanlon, D. O. and Walsh, A., 2016. Quasi-particle electronic band structure and alignment of the V-VI-VII semiconductors SbSI, SbSBr, and SbSeI for solar cells. Applied Physics Letters, 108 (11), 112103.

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