Aron Walsh, Ph.D. - Publications

Affiliations: 
2016- Materials Imperial College London, London, England, United Kingdom 
Area:
Computational Chemistry and Computational Materials Science
Website:
http://www.imperial.ac.uk/people/a.walsh

366 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2021 Jung YK, Kim S, Kim YC, Walsh A. Low Barrier for Exciton Self-Trapping Enables High Photoluminescence Quantum Yield in CsCuI. The Journal of Physical Chemistry Letters. 8447-8452. PMID 34437809 DOI: 10.1021/acs.jpclett.1c02252  1
2021 Gittins JW, Balhatchet CJ, Chen Y, Liu C, Madden DG, Britto S, Golomb MJ, Walsh A, Fairen-Jimenez D, Dutton SE, Forse AC. Insights into the electric double-layer capacitance of two-dimensional electrically conductive metal-organic frameworks. Journal of Materials Chemistry. A. 9: 16006-16015. PMID 34354834 DOI: 10.1039/d1ta04026j  1
2021 Harnett-Caulfield L, Walsh A. Assessment of interstitial potentials for rapid prediction of absolute band energies in crystals. The Journal of Chemical Physics. 155: 024113. PMID 34266274 DOI: 10.1063/5.0044866  0.01
2021 Whalley LD, van Gerwen P, Frost JM, Kim S, Hood SN, Walsh A. Giant Huang-Rhys Factor for Electron Capture by the Iodine Intersitial in Perovskite Solar Cells. Journal of the American Chemical Society. PMID 34102845 DOI: 10.1021/jacs.1c03064  1
2021 Huang YT, Kavanagh SR, Scanlon DO, Walsh A, Hoye R. Corrigendum: Perovskite-Inspired Materials for Photovoltaics and Beyond - From Design to Devices (2021 Nanotechnology 32 132004). Nanotechnology. PMID 34077912 DOI: 10.1088/1361-6528/ac074b  1
2021 Artrith N, Butler KT, Coudert FX, Han S, Isayev O, Jain A, Walsh A. Best practices in machine learning for chemistry. Nature Chemistry. 13: 505-508. PMID 34059804 DOI: 10.1038/s41557-021-00716-z  1
2021 Protesescu L, Calbo J, Williams K, Tisdale W, Walsh A, Dincă M. Colloidal nano-MOFs nucleate and stabilize ultra-small quantum dots of lead bromide perovskites. Chemical Science. 12: 6129-6135. PMID 33996009 DOI: 10.1039/d1sc00282a  1
2021 Kavanagh SR, Walsh A, Scanlon DO. Rapid Recombination by Cadmium Vacancies in CdTe. Acs Energy Letters. 6: 1392-1398. PMID 33869771 DOI: 10.1021/acsenergylett.1c00380  1
2021 Jedlicka E, Wang J, Mutch J, Jung YK, Went P, Mohammed J, Ziffer M, Giridharagopal R, Walsh A, Chu JH, Ginger DS. Bismuth Doping Alters Structural Phase Transitions in Methylammonium Lead Tribromide Single Crystals. The Journal of Physical Chemistry Letters. 2749-2755. PMID 33705146 DOI: 10.1021/acs.jpclett.1c00334  1
2021 Okenyi MTO, Ratcliff LE, Walsh A. Multi-phonon proton transfer pathway in a molecular organic ferroelectric crystal. Physical Chemistry Chemical Physics : Pccp. 23: 2885-2890. PMID 33475125 DOI: 10.1039/d0cp04236f  0.01
2020 Kobayashi Y, Hirata K, Hood SN, Yang H, Walsh A, Matsushita Y, Ishioka K. Correction: Crystal structure and metallization mechanism of the π-radical metal TED. Chemical Science. 11: 11945-11946. PMID 34125111 DOI: 10.1039/d0sc90231d  1
2020 Kobayashi Y, Hirata K, Hood SN, Yang H, Walsh A, Matsushita Y, Ishioka K. Crystal structure and metallization mechanism of the π-radical metal . Chemical Science. 11: 11699-11704. PMID 34123200 DOI: 10.1039/d0sc03521a  1
2020 Huang YT, Kavanagh SR, Scanlon DO, Walsh A, Hoye R. Perovskite-Inspired Materials for Photovoltaics and Beyond - From Design to Devices. Nanotechnology. PMID 33260167 DOI: 10.1088/1361-6528/abcf6d  1
2020 Reichert S, An Q, Woo YW, Walsh A, Vaynzof Y, Deibel C. Probing the ionic defect landscape in halide perovskite solar cells. Nature Communications. 11: 6098. PMID 33257707 DOI: 10.1038/s41467-020-19769-8  1
2020 Muscarella LA, Hutter EM, Wittmann F, Woo YW, Jung YK, McGovern L, Versluis J, Walsh A, Bakker HJ, Ehrler B. Lattice Compression Increases the Activation Barrier for Phase Segregation in Mixed-Halide Perovskites. Acs Energy Letters. 5: 3152-3158. PMID 33072865 DOI: 10.1021/Acsenergylett.0C01474  1
2020 Simenas M, Balciunas S, Wilson JN, Svirskas S, Kinka M, Garbaras A, Kalendra V, Gagor A, Szewczyk D, Sieradzki A, Maczka M, Samulionis V, Walsh A, Grigalaitis R, Banys J. Suppression of phase transitions and glass phase signatures in mixed cation halide perovskites. Nature Communications. 11: 5103. PMID 33037192 DOI: 10.1038/s41467-020-18938-z  1
2020 Morita K, Davies DW, Butler KT, Walsh A. Modeling the dielectric constants of crystals using machine learning. The Journal of Chemical Physics. 153: 024503. PMID 32668921 DOI: 10.1063/5.0013136  1
2020 Doherty TAS, Winchester AJ, Macpherson S, Johnstone DN, Pareek V, Tennyson EM, Kosar S, Kosasih FU, Anaya M, Abdi-Jalebi M, Andaji-Garmaroudi Z, Wong EL, Madéo J, Chiang YH, Park JS, ... ... Walsh A, et al. Performance-limiting nanoscale trap clusters at grain junctions in halide perovskites. Nature. 580: 360-366. PMID 32296189 DOI: 10.1038/S41586-020-2184-1  1
2020 Yang RX, Skelton JM, da Silva EL, Frost JM, Walsh A. Assessment of dynamic structural instabilities across 24 cubic inorganic halide perovskites. The Journal of Chemical Physics. 152: 024703. PMID 31941301 DOI: 10.1063/1.5131575  1
2020 Jones LAH, Linhart WM, Fleck N, Swallow JEN, Murgatroyd PAE, Shiel H, Featherstone TJ, Smiles MJ, Thakur PK, Lee T, Hardwick LJ, Alaria J, Jäckel F, Kudrawiec R, Burton LA, ... Walsh A, et al. Sn 5 s 2 lone pairs and the electronic structure of tin sulphides: A photoreflectance, high-energy photoemission, and theoretical investigation Physical Review Materials. 4: 74602. DOI: 10.1103/Physrevmaterials.4.074602  1
2020 Welch EW, Jung Y, Walsh A, Scolfaro L, Zakhidov A. A density functional theory study on the interface stability between CsPbBr3 and CuI Aip Advances. 10: 85023. DOI: 10.1063/5.0018925  0.12
2020 Golomb MJ, Calbo J, Bristow JK, Walsh A. Ligand engineering in Cu(II) paddle wheel metal–organic frameworks for enhanced semiconductivity Journal of Materials Chemistry. 8: 13160-13165. DOI: 10.1039/D0Ta04466K  1
2020 Kobayashi Y, Hirata K, Hood S, Yang H, Walsh A, Matsushita Y, Ishioka K. Crystal structure and metallization mechanism of the π-radical metal TED Chemical Science. DOI: 10.1039/D0Sc03521A  1
2020 Rahim W, Skelton JM, Savory CN, Evans IR, Evans JSO, Walsh A, Scanlon DO. Polymorph exploration of bismuth stannate using first-principles phonon mode mapping Chemical Science. 11: 7904-7909. DOI: 10.1039/D0Sc02995E  1
2020 Crovetto A, Kim S, Fischer M, Stenger N, Walsh A, Chorkendorff I, Vesborg PCK. Assessing the defect tolerance of kesterite-inspired solar absorbers Energy and Environmental Science. DOI: 10.1039/D0Ee02177F  1
2020 Kim S, Márquez JA, Unold T, Walsh A. Upper limit to the photovoltaic efficiency of imperfect crystals from first principles Energy and Environmental Science. 13: 1481-1491. DOI: 10.1039/D0Ee00291G  1
2020 Park J, Li Z, Wilson JN, Yin W, Walsh A. Hexagonal Stacking Faults Act as Hole-Blocking Layers in Lead Halide Perovskites Acs Energy Letters. 5: 2231-2233. DOI: 10.1021/Acsenergylett.0C01124  0.24
2020 Moss B, Le H, Corby S, Morita K, Selim S, Sotelo-Vazquez C, Chen Y, Borthwick A, Wilson A, Blackman C, Durrant JR, Walsh A, Kafizas A. Anisotropic Electron Transport Limits Performance in Bi2WO6 Photoanodes Journal of Physical Chemistry C. 124: 18859-18867. DOI: 10.1021/Acs.Jpcc.0C03539  1
2020 Yang H, Savory CN, Morgan BJ, Scanlon DO, Skelton JM, Walsh A. Chemical Trends in the Lattice Thermal Conductivity of Li(Ni, Mn, Co)O2 (NMC) Battery Cathodes Chemistry of Materials. 32: 7542-7550. DOI: 10.1021/Acs.Chemmater.0C02908  1
2020 Silva EL, Santos MC, Skelton JM, Yang T, Santos T, Parker SC, Walsh A. Electronic and Phonon Instabilities in Bilayer Graphene under Applied External Bias Materials Today: Proceedings. 20: 373-382. DOI: 10.1016/J.Matpr.2019.10.076  1
2019 Davies DW, Savory CN, Frost JM, Scanlon DO, Morgan BJ, Walsh A. Descriptors for Electron and Hole Charge Carriers in Metal Oxides. The Journal of Physical Chemistry Letters. PMID 31875393 DOI: 10.1021/Acs.Jpclett.9B03398  1
2019 Wang H, Jia J, Wang L, Butler K, Song R, Casillas G, He L, Kherani NP, Perovic DD, Jing L, Walsh A, Dittmeyer R, Ozin GA. Heterostructure Engineering of a Reverse Water Gas Shift Photocatalyst. Advanced Science (Weinheim, Baden-Wurttemberg, Germany). 6: 1902170. PMID 31763158 DOI: 10.1002/Advs.201902170  1
2019 Souto M, Calbo J, Mañas-Valero S, Walsh A, Mínguez Espallargas G. Charge-transfer interactions between fullerenes and a mesoporous tetrathiafulvalene-based metal-organic framework. Beilstein Journal of Nanotechnology. 10: 1883-1893. PMID 31598454 DOI: 10.3762/Bjnano.10.183  1
2019 Clough AJ, Orchanian NM, Skelton JM, Neer AJ, Howard SA, Downes CA, Piper LFJ, Walsh A, Melot BC, Marinescu SC. Room Temperature Metallic Conductivity in a Metal-Organic Framework Induced by Oxidation. Journal of the American Chemical Society. PMID 31553621 DOI: 10.1021/Jacs.9B06898  1
2019 Pastor E, Park JS, Steier L, Kim S, Grätzel M, Durrant JR, Walsh A, Bakulin AA. In situ observation of picosecond polaron self-localisation in α-FeO photoelectrochemical cells. Nature Communications. 10: 3962. PMID 31481691 DOI: 10.1038/S41467-019-11767-9  1
2019 Yang H, Yang JY, Savory CN, Skelton JM, Morgan BJ, Scanlon DO, Walsh A. Highly Anisotropic Thermal Transport in LiCoO. The Journal of Physical Chemistry Letters. PMID 31475830 DOI: 10.1021/Acs.Jpclett.9B02073  1
2019 Sachs M, Park JS, Pastor E, Kafizas A, Wilson AA, Francàs L, Gul S, Ling M, Blackman C, Yano J, Walsh A, Durrant JR. Effect of oxygen deficiency on the excited state kinetics of WO and implications for photocatalysis. Chemical Science. 10: 5667-5677. PMID 31293751 DOI: 10.1039/C9Sc00693A  1
2019 Aspuru-Guzik A, Baik MH, Balasubramanian S, Banerjee R, Bart S, Borduas-Dedekind N, Chang S, Chen P, Corminboeuf C, Coudert FX, Cronin L, Crudden C, Cuk T, Doyle AG, Fan C, ... ... Walsh A, et al. Charting a course for chemistry. Nature Chemistry. 11: 286-294. PMID 30903035 DOI: 10.1038/S41557-019-0236-7  1
2019 Zhang F, Kim DH, Lu H, Park JS, Larson B, Hu J, Gao L, Xiao C, Reid O, Chen X, Zhao Q, Ndione PF, Berry JJ, You W, Walsh A, et al. Enhanced Charge Transport in 2D Perovskite via Fluorination of Organic Cation. Journal of the American Chemical Society. PMID 30882210 DOI: 10.1021/Jacs.9B00972  1
2019 Ptak M, Svane KL, Walsh A, Paraguassu W. Stability and flexibility of heterometallic formate perovskites with the dimethylammonium cation: pressure-induced phase transitions. Physical Chemistry Chemical Physics : Pccp. PMID 30741281 DOI: 10.1039/C8Cp07131D  1
2019 Jones TW, Osherov A, Alsari M, Sponseller M, Duck BC, Jung YK, Settens C, Niroui F, Brenes R, Stan CV, Li Y, Abdi-Jalebi M, Tamura N, MacDonald JE, Burghammer M, ... ... Walsh A, et al. Lattice strain causes non-radiative losses in halide perovskites Energy and Environmental Science. 12: 596-606. DOI: 10.1039/C8Ee02751J  1
2019 Morita K, Park JS, Kim S, Yasuoka K, Walsh A. Crystal Engineering of Bi2WO6 to Polar Aurivillius-Phase Oxyhalides Journal of Physical Chemistry C. 123: 29155-29161. DOI: 10.1021/Acs.Jpcc.9B09806  1
2019 Davies DW, Butler KT, Walsh A. Data-Driven Discovery of Photoactive Quaternary Oxides Using First-Principles Machine Learning Chemistry of Materials. 31: 7221-7230. DOI: 10.1021/Acs.Chemmater.9B01519  1
2019 Wang H, Jia J, Wang L, Butler K, Song R, Casillas G, He L, Kherani NP, Perovic DD, Jing L, Walsh A, Dittmeyer R, Ozin GA. CO2 Photoreduction: Heterostructure Engineering of a Reverse Water Gas Shift Photocatalyst (Adv. Sci. 22/2019) Advanced Science. 6: 1970134. DOI: 10.1002/Advs.201970134  1
2018 Gold-Parker A, Gehring PM, Skelton JM, Smith IC, Parshall D, Frost JM, Karunadasa HI, Walsh A, Toney MF. Acoustic phonon lifetimes limit thermal transport in methylammonium lead iodide. Proceedings of the National Academy of Sciences of the United States of America. PMID 30401737 DOI: 10.1073/Pnas.1812227115  1
2018 Walsh A, Sokol AA, Buckeridge J, Scanlon DO, Catlow CRA. Oxidation states and ionicity. Nature Materials. PMID 30275565 DOI: 10.1038/S41563-018-0165-7  1
2018 Ptak M, Stefańska D, Gągor A, Svane KL, Walsh A, Paraguassu W. Heterometallic perovskite-type metal-organic framework with an ammonium cation: structure, phonons, and optical response of [NH]NaCrAl(HCOO) (x = 0, 0.025 and 0.5). Physical Chemistry Chemical Physics : Pccp. 20: 22284-22295. PMID 30123897 DOI: 10.1039/C8Cp03788D  1
2018 Steele JA, Puech P, Keshavarz M, Yang R, Banerjee S, Debroye E, Kim CW, Yuan H, Heo NH, Vanacken J, Walsh A, Hofkens J, Roeffaers MBJ. Giant Electron-Phonon Coupling and Deep Conduction Band Resonance in Metal Halide Double Perovskite. Acs Nano. PMID 30086242 DOI: 10.1021/Acsnano.8B02936  0.16
2018 Butler KT, Davies DW, Cartwright H, Isayev O, Walsh A. Machine learning for molecular and materials science. Nature. 559: 547-555. PMID 30046072 DOI: 10.1038/S41586-018-0337-2  1
2018 Souto M, Romero J, Calbo J, Vitorica-Yrezabal IJ, Zafra JL, Casado Cordón J, Ortí E, Walsh A, Minguez Espallargas G. Breathing-Dependent Redox Activity in a Tetrathiafulvalene-Based Metal-Organic Framework. Journal of the American Chemical Society. PMID 30040405 DOI: 10.1021/Jacs.8B05890  1
2018 Davies DW, Butler KT, Isayev O, Walsh A. Materials discovery by chemical analogy: role of oxidation states in structure prediction. Faraday Discussions. PMID 30027179 DOI: 10.1039/C8Fd00032H  1
2018 Svane KL, Bristow JK, Gale JD, Walsh A. Vacancy defect configurations in the metal-organic framework UiO-66: energetics and electronic structure. Journal of Materials Chemistry. A. 6: 8507-8513. PMID 30009026 DOI: 10.1039/C7Ta11155J  1
2018 Wei W, Li W, Butler KT, Feng G, Howard CJ, Carpenter MA, Lu P, Walsh A, Cheetham AK. Unusual Phase Transition Driven by Vibrational Entropy Changes in a Hybrid Organic-Inorganic Perovskite. Angewandte Chemie (International Ed. in English). PMID 29845741 DOI: 10.1002/Anie.201803176  1
2018 Davies DW, Butler KT, Skelton JM, Xie C, Oganov AR, Walsh A. Computer-aided design of metal chalcohalide semiconductors: from chemical composition to crystal structure. Chemical Science. 9: 1022-1030. PMID 29675149 DOI: 10.1039/C7Sc03961A  1
2018 Kye YH, Yu CJ, Jong UG, Chen Y, Walsh A. Critical Role of Water in Defect Aggregation and Chemical Degradation of Perovskite Solar Cells. The Journal of Physical Chemistry Letters. 2196-2201. PMID 29642701 DOI: 10.1021/Acs.Jpclett.8B00406  0.32
2018 Davies DW, Walsh A, Mudd JJ, McConville CF, Regoutz A, Kahk JM, Payne DJ, Dhanak VR, Hesp D, Pussi K, Lee T, Egdell RG, Zhang KHL. Identification of Lone-Pair Surface States on Indium Oxide The Journal of Physical Chemistry C. 123: 1700-1709. DOI: 10.1021/Acs.Jpcc.8B08623  1
2017 Jung YK, Lee JH, Walsh A, Soon A. Correction to Influence of Rb/Cs Cation-Exchange on Inorganic Sn Halide Perovskites: From Chemical Structure to Physical Properties. Chemistry of Materials : a Publication of the American Chemical Society. 29: 4603. PMID 31305611 DOI: 10.1021/Acs.Chemmater.7B01616  1
2017 Frost JM, Whalley LD, Walsh A. Slow Cooling of Hot Polarons in Halide Perovskite Solar Cells. Acs Energy Letters. 2: 2647-2652. PMID 29250603 DOI: 10.1021/Acsenergylett.7B00862  1
2017 Svane KL, Forse AC, Grey CP, Kieslich G, Cheetham AK, Walsh A, Butler KT. How Strong Is the Hydrogen Bond in Hybrid Perovskites? The Journal of Physical Chemistry Letters. 6154-6159. PMID 29216715 DOI: 10.1021/Acs.Jpclett.7B03106  1
2017 Bryant MJ, Skelton JM, Hatcher LE, Stubbs C, Madrid E, Pallipurath AR, Thomas LH, Woodall CH, Christensen J, Fuertes S, Robinson TP, Beavers CM, Teat SJ, Warren MR, Pradaux-Caggiano F, Walsh A, et al. A rapidly-reversible absorptive and emissive vapochromic Pt(II) pincer-based chemical sensor. Nature Communications. 8: 1800. PMID 29176716 DOI: 10.1038/S41467-017-01941-2  1
2017 Whalley LD, Frost JM, Jung YK, Walsh A. Perspective: Theory and simulation of hybrid halide perovskites. The Journal of Chemical Physics. 146: 220901. PMID 29166078 DOI: 10.1063/1.4984964  1
2017 Yang RX, Skelton JM, da Silva L, Frost JM, Walsh A. Spontaneous Octahedral Tilting in the Cubic Inorganic Caesium Halide Perovskites CsSnX3 and CsPbX3 (X = F, Cl, Br, I). The Journal of Physical Chemistry Letters. PMID 28903562 DOI: 10.1021/Acs.Jpclett.7B02423  1
2017 Walsh A, Zunger A. Instilling defect tolerance in new compounds. Nature Materials. PMID 28869612 DOI: 10.1038/Nmat4973  0.08
2017 Addicoat M, Bennett T, Chapman K, Denysenko D, Dincă M, Doan H, Easun T, Eddaoudi M, Farha O, Gagliardi L, Haase F, Hajiahmadi Farmahini A, Hendon C, Jorge M, Kitagawa S, ... ... Walsh A, et al. New directions in gas sorption and separation with MOFs: general discussion. Faraday Discussions. PMID 28832697 DOI: 10.1039/C7Fd90044A  1
2017 Addicoat M, Butler K, Farha O, Gagliardi L, Hajiahmadi Farmahini A, Hendon C, Jorge M, Kitagawa S, Lamberti C, Lee JM, Li J, Liu X, Moggach S, Ranocchiari M, Sarkisov L, ... ... Walsh A, et al. MOFs modeling and theory: general discussion. Faraday Discussions. PMID 28832694 DOI: 10.1039/C7Fd90045G  1
2017 Carraro F, Chapman K, Chen Z, Dincă M, Easun T, Eddaoudi M, Farha O, Forgan R, Gagliardi L, Haase F, Harris D, Kitagawa S, Knichal J, Lamberti C, Lee JM, ... ... Walsh A, et al. Catalysis in MOFs: general discussion. Faraday Discussions. PMID 28832064 DOI: 10.1039/C7Fd90046E  1
2017 Banerjee T, Bennett T, Butler K, Easun TL, Eddaoudi M, Forgan R, Gagliardi L, Hendon C, Jorge M, Lamberti C, Lee JM, Leus K, Li J, Lin W, Ranocchiari M, ... ... Walsh A, et al. Electronic, magnetic and photophysical properties of MOFs and COFs: general discussion. Faraday Discussions. PMID 28832059 DOI: 10.1039/C7Fd90043K  1
2017 Clough AJ, Skelton JM, Downes CA, De la Rosa A, Yoo JW, Walsh A, Melot BC, Marinescu SC. Metallic Conductivity in a Two-Dimensional Cobalt Dithiolene Metal-Organic Framework. Journal of the American Chemical Society. PMID 28704606 DOI: 10.1021/Jacs.7B05742  1
2017 Skelton JM, Burton LA, Oba F, Walsh A. Chemical and Lattice Stability of the Tin Sulfides. The Journal of Physical Chemistry. C, Nanomaterials and Interfaces. 121: 6446-6454. PMID 28652889 DOI: 10.1021/Acs.Jpcc.6B12581  1
2017 Jia J, Qian C, Dong Y, Li YF, Wang H, Ghoussoub M, Butler KT, Walsh A, Ozin GA. Heterogeneous catalytic hydrogenation of CO2 by metal oxides: defect engineering - perfecting imperfection. Chemical Society Reviews. PMID 28635998 DOI: 10.1039/C7Cs00026J  1
2017 Butler KT, Hendon CH, Walsh A. Designing porous electronic thin-film devices: band offsets and heteroepitaxy. Faraday Discussions. PMID 28621379 DOI: 10.1039/C7Fd00019G  1
2017 Sun L, Hendon CH, Park SS, Tulchinsky Y, Wan R, Wang F, Walsh A, Dincă M. Is iron unique in promoting electrical conductivity in MOFs? Chemical Science. 8: 4450-4457. PMID 28616149 DOI: 10.1039/C7Sc00647K  1
2017 Hendon CH, Butler KT, Ganose AM, Román-Leshkov Y, Scanlon DO, Ozin GA, Walsh A. Electroactive Nanoporous Metal Oxides and Chalcogenides by Chemical Design. Chemistry of Materials : a Publication of the American Chemical Society. 29: 3663-3670. PMID 28572706 DOI: 10.1021/Acs.Chemmater.7B00464  1
2017 Kaltzoglou A, Stoumpos CC, Kontos AG, Manolis GK, Papadopoulos K, Papadokostaki KG, Psycharis V, Tang CC, Jung YK, Walsh A, Kanatzidis MG, Falaras P. Trimethylsulfonium Lead Triiodide: An Air-Stable Hybrid Halide Perovskite. Inorganic Chemistry. PMID 28509542 DOI: 10.1021/Acs.Inorgchem.7B00395  1
2017 Skelton JM, Burton LA, Jackson AJ, Oba F, Parker SC, Walsh A. Lattice dynamics of the tin sulphides SnS2, SnS and Sn2S3: vibrational spectra and thermal transport. Physical Chemistry Chemical Physics : Pccp. PMID 28470289 DOI: 10.1039/C7Cp01680H  1
2017 Walsh A, Sokol AA, Buckeridge J, Scanlon DO, Catlow CRA. Electron Counting in Solids: Oxidation States, Partial Charges, and Ionicity. The Journal of Physical Chemistry Letters. 8: 2074-2075. PMID 28468501 DOI: 10.1021/Acs.Jpclett.7B00809  1
2017 Jung YK, Lee JH, Walsh A, Soon A. Influence of Rb/Cs Cation-Exchange on Inorganic Sn Halide Perovskites: From Chemical Structure to Physical Properties. Chemistry of Materials : a Publication of the American Chemical Society. 29: 3181-3188. PMID 28435185 DOI: 10.1021/Acs.Chemmater.7B00260  1
2017 Svane KL, Walsh A. Quantifying Thermal Disorder in Metal-Organic Frameworks: Lattice Dynamics and Molecular Dynamics Simulations of Hybrid Formate Perovskites. The Journal of Physical Chemistry. C, Nanomaterials and Interfaces. 121: 421-429. PMID 28298951 DOI: 10.1021/Acs.Jpcc.6B10714  1
2017 Park SS, Hendon CH, Fielding AJ, Walsh A, O'Keeffe M, Dinca M. The Organic Secondary Building Unit: Strong Intermolecular π-Interactions Define Topology in MIT-25, a Mesoporous MOF with Proton-Replete Channels. Journal of the American Chemical Society. PMID 28240898 DOI: 10.1021/Jacs.6B13176  1
2017 Fritsch D, Morgan BJ, Walsh A. Self-Consistent Hybrid Functional Calculations: Implications for Structural, Electronic, and Optical Properties of Oxide Semiconductors. Nanoscale Research Letters. 12: 19. PMID 28058655 DOI: 10.1186/S11671-016-1779-9  1
2017 Whalley LD, Crespo-Otero R, Walsh A. H-Center and V-Center Defects in Hybrid Halide Perovskites Acs Energy Letters. 2: 2713-2714. DOI: 10.1021/Acsenergylett.7B00995  1
2016 Bhachu DS, Moniz SJA, Sathasivam S, Scanlon DO, Walsh A, Bawaked SM, Mokhtar M, Obaid AY, Parkin IP, Tang J, Carmalt CJ. Bismuth oxyhalides: synthesis, structure and photoelectrochemical activity. Chemical Science. 7: 4832-4841. PMID 30155131 DOI: 10.1039/C6Sc00389C  1
2016 Jackson AJ, Tiana D, Walsh A. A universal chemical potential for sulfur vapours. Chemical Science. 7: 1082-1092. PMID 29896372 DOI: 10.1039/C5Sc03088A  1
2016 Butler KT, Walsh A, Cheetham AK, Kieslich G. Organised chaos: entropy in hybrid inorganic-organic systems and other materials. Chemical Science. 7: 6316-6324. PMID 28567243 DOI: 10.1039/C6Sc02199A  1
2016 Woodall CH, Christensen J, Skelton JM, Hatcher LE, Parlett A, Raithby PR, Walsh A, Parker SC, Beavers CM, Teat SJ, Intissar M, Reber C, Allan DR. Observation of a re-entrant phase transition in the molecular complex tris(μ2-3,5-diiso-propyl-1,2,4-triazolato-κ(2)N(1):N(2))trigold(I) under high pressure. Iucrj. 3: 367-376. PMID 28461897 DOI: 10.1107/S2052252516013129  1
2016 Savory CN, Walsh A, Scanlon DO. Can Pb-Free Halide Double Perovskites Support High-Efficiency Solar Cells? Acs Energy Letters. 1: 949-955. PMID 28066823 DOI: 10.1021/Acsenergylett.6B00471  1
2016 Jackson AJ, Tiana D, Walsh A. Correction: A universal chemical potential for sulfur vapours. Chemical Science. 7: 6574. PMID 28042462 DOI: 10.1039/C6Sc90058E  1
2016 Hendon CH, Pradaux-Caggiano F, Hatcher LE, Gee WJ, Wilson CC, Butler KT, Carbery DR, Walsh A, Melot BC. Magnetic coupling in a hybrid Mn(ii) acetylene dicarboxylate. Physical Chemistry Chemical Physics : Pccp. PMID 27897285 DOI: 10.1039/C6Cp06886C  1
2016 Davies DW, Butler KT, Jackson AJ, Morris A, Frost JM, Skelton JM, Walsh A. Computational Screening of All Stoichiometric Inorganic Materials. Chem. 1: 617-627. PMID 27790643 DOI: 10.1016/J.Chempr.2016.09.010  1
2016 Hendon CH, Hunt ST, Milina M, Butler KT, Walsh A, Román-Leshkov Y. Realistic Surface Descriptions of Heterometallic Interfaces: The Case of TiWC Coated in Noble Metals. The Journal of Physical Chemistry Letters. 4475-4482. PMID 27786468 DOI: 10.1021/Acs.Jpclett.6B02293  1
2016 Bristow JK, Skelton JM, Svane KL, Walsh A, Gale JD. A general forcefield for accurate phonon properties of metal-organic frameworks. Physical Chemistry Chemical Physics : Pccp. PMID 27731872 DOI: 10.1039/C6Cp05106E  1
2016 Walsh A, Padure NP, Il Seok S. Physical chemistry of hybrid perovskite solar cells. Physical Chemistry Chemical Physics : Pccp. 18: 27024-27025. PMID 27711750 DOI: 10.1039/C6Cp90212J  0.01
2016 Bristow JK, Svane KL, Tiana D, Skelton JM, Gale JD, Walsh A. Free Energy of Ligand Removal in the Metal-Organic Framework UiO-66. The Journal of Physical Chemistry. C, Nanomaterials and Interfaces. 120: 9276-9281. PMID 27610208 DOI: 10.1021/Acs.Jpcc.6B01659  1
2016 Skelton JM, Burton LA, Parker SC, Walsh A, Kim CE, Soon A, Buckeridge J, Sokol AA, Catlow CR, Togo A, Tanaka I. Anharmonicity in the High-Temperature Cmcm Phase of SnSe: Soft Modes and Three-Phonon Interactions. Physical Review Letters. 117: 075502. PMID 27563974 DOI: 10.1103/Physrevlett.117.075502  1
2016 Leguy AM, Goñi AR, Frost JM, Skelton J, Brivio F, Rodríguez-Martínez X, Weber OJ, Pallipurath A, Alonso MI, Campoy-Quiles M, Weller MT, Nelson J, Walsh A, Barnes PR. Dynamic disorder, phonon lifetimes, and the assignment of modes to the vibrational spectra of methylammonium lead halide perovskites. Physical Chemistry Chemical Physics : Pccp. PMID 27346792 DOI: 10.1039/C6Cp03474H  1
2016 Hendon CH, Walsh A, Akiyama N, Konno Y, Kajiwara T, Ito T, Kitagawa H, Sakai K. One-dimensional Magnus-type platinum double salts. Nature Communications. 7: 11950. PMID 27320502 DOI: 10.1038/Ncomms11950  1
2016 Ganose AM, Cuff M, Butler KT, Walsh A, Scanlon DO. Interplay of Orbital and Relativistic Effects in Bismuth Oxyhalides: BiOF, BiOCl, BiOBr, and BiOI. Chemistry of Materials : a Publication of the American Chemical Society. 28: 1980-1984. PMID 27274616 DOI: 10.1021/Acs.Chemmater.6B00349  1
2016 Hendon CH, Walsh A, Dincă M. Frontier Orbital Engineering of Metal-Organic Frameworks with Extended Inorganic Connectivity: Porous Alkaline-Earth Oxides. Inorganic Chemistry. PMID 27267149 DOI: 10.1021/Acs.Inorgchem.6B00979  1
2016 Nasalevich MA, Hendon CH, Santaclara JG, Svane K, van der Linden B, Veber SL, Fedin MV, Houtepen AJ, van der Veen MA, Kapteijn F, Walsh A, Gascon J. Electronic origins of photocatalytic activity in d(0) metal organic frameworks. Scientific Reports. 6: 23676. PMID 27020767 DOI: 10.1038/Srep23676  1
2016 Butler KT, Frost JM, Skelton JM, Svane KL, Walsh A. Computational materials design of crystalline solids. Chemical Society Reviews. PMID 26992173 DOI: 10.1039/C5Cs00841G  1
2016 Brivio F, Caetano C, Walsh A. Thermodynamic Origin of Photoinstability in The CH3NH3Pb(I1-xBrx)3 Hybrid Halide Perovskite Alloy. The Journal of Physical Chemistry Letters. PMID 26952337 DOI: 10.1021/Acs.Jpclett.6B00226  1
2016 Frost JM, Walsh A. What Is Moving in Hybrid Halide Perovskite Solar Cells? Accounts of Chemical Research. PMID 26859250 DOI: 10.1021/Acs.Accounts.5B00431  1
2016 Hendon CH, Bonnefoy J, Quadrelli EA, Canivet J, Chambers MB, Rousse G, Walsh A, Fontecave M, Mellot-Draznieks C. A simple and non-destructive method for assessing the incorporation of bipyridine dicarboxylates as linkers within metal-organic frameworks. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 26807710 DOI: 10.1002/Chem.201600143  1
2016 Shibuya T, Skelton JM, Jackson AJ, Yasuoka K, Togo A, Tanaka I, Walsh A. Suppression of lattice thermal conductivity by mass-conserving cation mutation in multi-component semiconductors Apl Materials. 4. DOI: 10.1063/1.4955401  1
2016 Bhachu DS, Moniz SJA, Sathasivam S, Scanlon DO, Walsh A, Bawaked SM, Mokhtar M, Obaid AY, Parkin IP, Tang J, Carmalt CJ. Bismuth oxyhalides: Synthesis, structure and photoelectrochemical activity Chemical Science. 7: 4832-4841. DOI: 10.1039/c6sc00389c  1
2016 Ganose AM, Butler KT, Walsh A, Scanlon DO. Relativistic electronic structure and band alignment of BiSI and BiSeI: Candidate photovoltaic materials Journal of Materials Chemistry A. 4: 2060-2068. DOI: 10.1039/C5Ta09612J  1
2016 Jackson AJ, Tiana D, Walsh A. A universal chemical potential for sulfur vapours Chemical Science. 7: 1082-1092. DOI: 10.1039/c5sc03088a  1
2016 Wahila MJ, Butler KT, Lebens-Higgins ZW, Hendon CH, Nandur AS, Treharne RE, Quackenbush NF, Sallis S, Mason K, Paik H, Schlom DG, Woicik JC, Guo J, Arena DA, White BE, ... ... Walsh A, et al. Lone-Pair Stabilization in Transparent Amorphous Tin Oxides: A Potential Route to p-Type Conduction Pathways Chemistry of Materials. 28: 4706-4713. DOI: 10.1021/Acs.Chemmater.6B01608  1
2016 Kieslich G, Forse AC, Sun S, Butler KT, Kumagai S, Wu Y, Warren MR, Walsh A, Grey CP, Cheetham AK. Role of Amine-Cavity Interactions in Determining the Structure and Mechanical Properties of the Ferroelectric Hybrid Perovskite [NH3NH2]Zn(HCOO)3 Chemistry of Materials. 28: 312-317. DOI: 10.1021/Acs.Chemmater.5B04143  1
2015 Hendon CH, Walsh A. Chemical principles underpinning the performance of the metal-organic framework HKUST-1. Chemical Science. 6: 3674-3683. PMID 28706713 DOI: 10.1039/C5Sc01489A  1
2015 Bakulin AA, Selig O, Bakker HJ, Rezus YL, Müller C, Glaser T, Lovrincic R, Sun Z, Chen Z, Walsh A, Frost JM, Jansen TL. Real-Time Observation of Organic Cation Reorientation in Methylammonium Lead Iodide Perovskites. The Journal of Physical Chemistry Letters. 6: 3663-3669. PMID 26722739 DOI: 10.1021/Acs.Jpclett.5B01555  1
2015 Cadman LK, Bristow JK, Stubbs NE, Tiana D, Mahon MF, Walsh A, Burrows AD. Compositional control of pore geometry in multivariate metal-organic frameworks: an experimental and computational study. Dalton Transactions (Cambridge, England : 2003). PMID 26660286 DOI: 10.1039/C5Dt04045K  1
2015 Scanlon DO, Walsh A. Polymorph engineering of CuMO2 (M = Al, Ga, Sc, Y) semiconductors for solar energy applications: from delafossite to wurtzite. Acta Crystallographica Section B, Structural Science, Crystal Engineering and Materials. 71: 702-6. PMID 26634726 DOI: 10.1107/S2052520615018387  1
2015 Yang RX, Butler KT, Walsh A. Assessment of Hybrid Organic-Inorganic Antimony Sulfides for Earth-Abundant Photovoltaic Applications. The Journal of Physical Chemistry Letters. PMID 26624204 DOI: 10.1021/Acs.Jpclett.5B02555  1
2015 Jackson AJ, Skelton JM, Hendon CH, Butler KT, Walsh A. Crystal structure optimisation using an auxiliary equation of state. The Journal of Chemical Physics. 143: 184101. PMID 26567640 DOI: 10.1063/1.4934716  1
2015 Park HS, Yun I, Walsh A. Early Puberty, School Context, and Delinquency Among South Korean Girls. International Journal of Offender Therapy and Comparative Criminology. PMID 26510630 DOI: 10.1177/0306624X15611374  0.76
2015 Walsh AJ, Castellanos JA, Nagathihalli NS, Merchant NB, Skala MC. Optical Imaging of Drug-Induced Metabolism Changes in Murine and Human Pancreatic Cancer Organoids Reveals Heterogeneous Drug Response. Pancreas. PMID 26495796 DOI: 10.1097/Mpa.0000000000000543  1
2015 Scheuermann AG, Lawrence JP, Kemp KW, Ito T, Walsh A, Chidsey CE, Hurley PK, McIntyre PC. Design principles for maximizing photovoltage in metal-oxide-protected water-splitting photoanodes. Nature Materials. PMID 26480231 DOI: 10.1038/Nmat4451  1
2015 Paramsothy S, Walsh AJ, Borody T, Samuel D, van den Bogaerde J, Leong RW, Connor S, Ng W, Mitchell HM, Kaakoush NO, Kamm MA. Gastroenterologist perceptions of faecal microbiota transplantation. World Journal of Gastroenterology. 21: 10907-14. PMID 26478682 DOI: 10.3748/wjg.v21.i38.10907  1
2015 Leguy AM, Azarhoosh P, Alonso MI, Campoy-Quiles M, Weber OJ, Yao J, Bryant D, Weller MT, Nelson J, Walsh A, van Schilfgaarde M, Barnes PR. Experimental and theoretical optical properties of methylammonium lead halide perovskites. Nanoscale. PMID 26477295 DOI: 10.1039/C5Nr05435D  1
2015 Clavet D, Antao V, Koppula S, Walsh A. Transform a teaching moment into your own learning moment: Fundamental Teaching Activities Framework. Canadian Family Physician MéDecin De Famille Canadien. 61: e484-8. PMID 26472807  1
2015 Clavet D, Antao V, Koppula S, Walsh A. [Transformez une occasion d'enseignement en une occasion d'apprentissage pour vous-même: Référentiel des activités pédagogiques fondamentales]. Canadian Family Physician Medecin De Famille Canadien. 61: 913-917. PMID 26472798  1
2015 Hamilton K, Spinks T, White KM, Kavanagh DJ, Walsh AM. A psychosocial analysis of parents' decisions for limiting their young child's screen time: An examination of attitudes, social norms and roles, and control perceptions. British Journal of Health Psychology. PMID 26462456 DOI: 10.1111/bjhp.12168  1
2015 Walsh A. Taking knowledge to new levels. Australian Nursing & Midwifery Journal. 23: 38-9. PMID 26454991  0.01
2015 Grancini G, Srimath Kandada AR, Frost JM, Barker AJ, De Bastiani M, Gandini M, Marras S, Lanzani G, Walsh A, Petrozza A. Role of Microstructure in the Electron-Hole Interaction of Hybrid Lead-Halide Perovskites. Nature Photonics. 9: 695-701. PMID 26442125 DOI: 10.1038/Nphoton.2015.151  1
2015 Monteiro SD, Walsh A, Grierson LE. OSCE circuit performance effects: Does circuit order influence scores? Medical Teacher. 1-3. PMID 26421751 DOI: 10.3109/0142159X.2015.1075647  1
2015 Walsh A, Kearney L, Dennis N. Factors influencing first-time mothers' introduction of complementary foods: a qualitative exploration. Bmc Public Health. 15: 939. PMID 26395331 DOI: 10.1186/s12889-015-2250-z  0.01
2015 Mehta G, Kumarasamy S, Wu J, Walsh A, Liu L, Williams K, Joe B, de la Serna IL. MITF interacts with the SWI/SNF subunit, BRG1, to promote GATA4 expression in cardiac hypertrophy. Journal of Molecular and Cellular Cardiology. PMID 26388265 DOI: 10.1016/J.Yjmcc.2015.09.010  1
2015 Gearhart MD, Erickson JR, Walsh A, Echeverri K. Identification of Conserved and Novel MicroRNAs during Tail Regeneration in the Mexican Axolotl. International Journal of Molecular Sciences. 16: 22046-61. PMID 26378530 DOI: 10.3390/Ijms160922046  1
2015 Dimitrievska M, Xie H, Jackson AJ, Fontané X, Espíndola-Rodríguez M, Saucedo E, Pérez-Rodríguez A, Walsh A, Izquierdo-Roca V. Resonant Raman scattering of ZnSxSe1-x solid solutions: the role of S and Se electronic states. Physical Chemistry Chemical Physics : Pccp. PMID 26376836 DOI: 10.1039/C5Cp04498G  1
2015 Campos-Delgado DU, Navarro OG, Arce-Santana ER, Walsh AJ, Skala MC, Jo JA. Deconvolution of fluorescence lifetime imaging microscopy by a library of exponentials. Optics Express. 23: 23748-67. PMID 26368470 DOI: 10.1364/Oe.23.023748  1
2015 Kieslich G, Kumagai S, Butler KT, Okamura T, Hendon CH, Sun S, Yamashita M, Walsh A, Cheetham AK. Role of entropic effects in controlling the polymorphism in formate ABX3 metal-organic frameworks. Chemical Communications (Cambridge, England). PMID 26351703 DOI: 10.1039/C5Cc06190C  1
2015 Fry J, Casanova PJ, Hamoutene D, Lush L, Walsh A, Couturier C. The Impact of Egg Ozonation on Hatching Success, Larval Growth, and Survival of Atlantic Cod, Atlantic Salmon, and Rainbow Trout. Journal of Aquatic Animal Health. 27: 57-64. PMID 26306334  1
2015 Walsh AD, Cameron AJ, Hesketh KD, Crawford D, Campbell KJ. Associations between dietary intakes of first-time fathers and their 20-month-old children are moderated by fathers' BMI, education and age. The British Journal of Nutrition. 1-7. PMID 26281910 DOI: 10.1017/S0007114515002755  1
2015 Skelton JM, Tiana D, Parker SC, Togo A, Tanaka I, Walsh A. Influence of the exchange-correlation functional on the quasi-harmonic lattice dynamics of II-VI semiconductors. The Journal of Chemical Physics. 143: 064710. PMID 26277159 DOI: 10.1063/1.4928058  1
2015 Thiébaut FI, White SJ, Walsh A, Klargaard SK, Wu HC, Rees G, Burgess PW. Does Faux Pas Detection in Adult Autism Reflect Differences in Social Cognition or Decision-Making Abilities? Journal of Autism and Developmental Disorders. PMID 26276266 DOI: 10.1007/s10803-015-2551-1  0.01
2015 Allen AP, Naughton M, Dowling J, Walsh A, Ismail F, Shorten G, Scott L, McLoughlin DM, Cryan JF, Dinan TG, Clarke G. Serum BDNF as a peripheral biomarker of treatment-resistant depression and the rapid antidepressant response: A comparison of ketamine and ECT. Journal of Affective Disorders. 186: 306-311. PMID 26275358 DOI: 10.1016/J.Jad.2015.06.033  1
2015 Nagathihalli NS, Castellanos JA, Shi C, Beesetty Y, Reyzer ML, Caprioli R, Chen X, Walsh AJ, Skala MC, Moses HL, Merchant NB. Signal Transducer and Activator of Transcription 3, Mediated Remodeling of the Tumor Microenvironment Results in Enhanced Tumor Drug Delivery in a Mouse Model of Pancreatic Cancer. Gastroenterology. PMID 26255562 DOI: 10.1053/J.Gastro.2015.07.058  1
2015 Koehler SM, Walsh A, Lovy AJ, Pruzansky JS, Shukla DR, Hausman MR. Outcomes of arthroscopic treatment of osteochondritis dissecans of the capitellum and description of the technique. Journal of Shoulder and Elbow Surgery / American Shoulder and Elbow Surgeons ... [Et Al.]. 24: 1607-12. PMID 26234666 DOI: 10.1016/j.jse.2015.06.013  1
2015 Fencl JL, Walsh A, Vocke D. The bariatric patient: an overview of perioperative care. Aorn Journal. 102: 116-31. PMID 26227516 DOI: 10.1016/j.aorn.2015.05.007  1
2015 Campos-Delgado DU, Gutierrez-Navarro O, Arce-Santana ER, Skala MC, Walsh AJ, Jo JA. Blind deconvolution estimation of fluorescence measurements through quadratic programming. Journal of Biomedical Optics. 20: 075010. PMID 26222960 DOI: 10.1117/1.Jbo.20.7.075010  1
2015 Walsh A, Barnes M, Mitchell AE. Nursing care of children in general practice settings: roles and responsibilities. Journal of Advanced Nursing. 71: 2585-94. PMID 26222091 DOI: 10.1111/jan.12735  1
2015 Buckeridge J, Catlow CR, Scanlon DO, Keal TW, Sherwood P, Miskufova M, Walsh A, Woodley SM, Sokol AA. Buckeridge et al. Reply. Physical Review Letters. 115: 029702. PMID 26207509 DOI: 10.1103/Physrevlett.115.029702  1
2015 Crespo-Otero R, Walsh A. Variation in Surface Ionization Potentials of Pristine and Hydrated BiVO4. The Journal of Physical Chemistry Letters. 6: 2379-83. PMID 26191376 DOI: 10.1021/Acs.Jpclett.5B00966  1
2015 Leguy AM, Frost JM, McMahon AP, Sakai VG, Kockelmann W, Law C, Li X, Foglia F, Walsh A, O'Regan BC, Nelson J, Cabral JT, Barnes PR. Corrigendum: The dynamics of methylammonium ions in hybrid organic-inorganic perovskite solar cells. Nature Communications. 6: 7780. PMID 26190505 DOI: 10.1038/Ncomms8780  1
2015 Josefson M, Walsh A, Abrahamsson K. Imaging and Identification of Marine Algal Bioactive Compounds by Surface Enhanced Raman Spectroscopy (SERS). Methods in Molecular Biology (Clifton, N.J.). 1308: 365-74. PMID 26108518 DOI: 10.1007/978-1-4939-2684-8_23  1
2015 Eames C, Frost JM, Barnes PR, O'Regan BC, Walsh A, Islam MS. Ionic transport in hybrid lead iodide perovskite solar cells. Nature Communications. 6: 7497. PMID 26105623 DOI: 10.1038/Ncomms8497  1
2015 Walsh A. Compensation for Blood Plasma Donation as a Distinctive Ethical Hazard: Reformulating the Commodification Objection. Hec Forum : An Interdisciplinary Journal On Hospitals' Ethical and Legal Issues. PMID 26100662 DOI: 10.1007/s10730-015-9287-3  0.01
2015 Murray AT, Dowley MJ, Pradaux-Caggiano F, Baldansuren A, Fielding AJ, Tuna F, Hendon CH, Walsh A, Lloyd-Jones GC, John MP, Carbery DR. Catalytic Amine Oxidation under Ambient Aerobic Conditions: Mimicry of Monoamine Oxidase B. Angewandte Chemie (International Ed. in English). 54: 8997-9000. PMID 26087676 DOI: 10.1002/Anie.201503654  1
2015 Paramsothy S, Borody TJ, Lin E, Finlayson S, Walsh AJ, Samuel D, van den Bogaerde J, Leong RW, Connor S, Ng W, Mitchell HM, Kaakoush N, Kamm MA. Donor Recruitment for Fecal Microbiota Transplantation. Inflammatory Bowel Diseases. 21: 1600-6. PMID 26070003 DOI: 10.1097/MIB.0000000000000405  1
2015 Dowling C, Moran D, Walsh A, Alsinnawi M, Flynn R, McDermott TE, Grainger R, Thornhill JA. Transurethral resection of the prostate--"now and then". Irish Medical Journal. 108: 144-6. PMID 26062241  0.01
2015 Leguy AM, Frost JM, McMahon AP, Sakai VG, Kochelmann W, Law C, Li X, Foglia F, Walsh A, O'Regan BC, Nelson J, Cabral JT, Barnes PR. The dynamics of methylammonium ions in hybrid organic-inorganic perovskite solar cells. Nature Communications. 6: 7124. PMID 26023041 DOI: 10.1038/Ncomms8124  1
2015 Bryant RV, Burger DC, Delo J, Walsh AJ, Thomas S, von Herbay A, Buchel OC, White L, Brain O, Keshav S, Warren BF, Travis SP. Beyond endoscopic mucosal healing in UC: histological remission better predicts corticosteroid use and hospitalisation over 6 years of follow-up. Gut. PMID 25986946 DOI: 10.1136/gutjnl-2015-309598  1
2015 Cobzas D, Sun H, Walsh AJ, Lebel RM, Blevins G, Wilman AH. Subcortical gray matter segmentation and voxel-based analysis using transverse relaxation and quantitative susceptibility mapping with application to multiple sclerosis. Journal of Magnetic Resonance Imaging : Jmri. PMID 25980643 DOI: 10.1002/Jmri.24951  1
2015 Crema AS, Walsh A, Yamane IS, Ventura BV, Santhiago MR. Femtosecond Laser-assisted Cataract Surgery in Patients With Marfan Syndrome and Subluxated Lens. Journal of Refractive Surgery (Thorofare, N.J. : 1995). 31: 338-41. PMID 25974974 DOI: 10.3928/1081597X-20150424-02  1
2015 Walsh AM, Kapoor GS, Buonato JM, Mathew LK, Bi Y, Davuluri RV, Martinez-Lage M, Simon MC, O'Rourke DM, Lazzara MJ. Sprouty2 Drives Drug Resistance and Proliferation in Glioblastoma. Molecular Cancer Research : McR. PMID 25934697 DOI: 10.1158/1541-7786.Mcr-14-0183-T  1
2015 Sun L, Hendon CH, Minier MA, Walsh A, Dincă M. Million-Fold Electrical Conductivity Enhancement in Fe2(DEBDC) versus Mn2(DEBDC) (E = S, O). Journal of the American Chemical Society. 137: 6164-7. PMID 25932955 DOI: 10.1021/Jacs.5B02897  1
2015 Murray AT, Frost JM, Hendon CH, Molloy CD, Carbery DR, Walsh A. Modular design of SPIRO-OMeTAD analogues as hole transport materials in solar cells. Chemical Communications (Cambridge, England). 51: 8935-8. PMID 25924849 DOI: 10.1039/C5Cc02129D  1
2015 Brennan SA, Ní Fhoghlú C, Devitt BM, O'Mahony FJ, Brabazon D, Walsh A. Silver nanoparticles and their orthopaedic applications. The Bone & Joint Journal. 97: 582-9. PMID 25922449 DOI: 10.1302/0301-620X.97B5.33336  1
2015 Lynagh Y, Mac Aogáin M, Walsh A, Rogers TR, Unemo M, Crowley B. Detailed characterization of the first high-level azithromycin-resistant Neisseria gonorrhoeae cases in Ireland. The Journal of Antimicrobial Chemotherapy. 70: 2411-3. PMID 25907073 DOI: 10.1093/jac/dkv106  0.04
2015 Walsh AM, Hamilton K, White KM, Hyde MK. Use of online health information to manage children's health care: a prospective study investigating parental decisions. Bmc Health Services Research. 15: 131. PMID 25889493 DOI: 10.1186/s12913-015-0793-4  1
2015 Walsh A, Phelan F, Phelan M, Ryan M, Healy F, Slattery DM, Elnazir B, Greally P, Linnane B, Ní Chróinín M, Mullane D, Herzig M, Cox DW, Javadpour S, McNally P. Diagnosis and treatment of sleep related breathing disorders in children: 2007 to 2011. Irish Medical Journal. 108: 71-3. PMID 25876296  1
2015 Walsh A. Principles of Chemical Bonding and Band Gap Engineering in Hybrid Organic-Inorganic Halide Perovskites. The Journal of Physical Chemistry. C, Nanomaterials and Interfaces. 119: 5755-5760. PMID 25838846 DOI: 10.1021/Jp512420B  0.01
2015 Walsh A. Inorganic materials: The quest for new functionality. Nature Chemistry. 7: 274-5. PMID 25803462 DOI: 10.1038/Nchem.2213  0.01
2015 Walsh AJ, Skala MC. Optical metabolic imaging quantifies heterogeneous cell populations. Biomedical Optics Express. 6: 559-73. PMID 25780745 DOI: 10.1364/Boe.6.000559  1
2015 Costello SP, Ghaly S, Beswick L, Pudipeddi A, Agarwal A, Sechi A, O'Connor S, Connor SJ, Sparrow MP, Bampton P, Walsh AJ, Andrews JM. Compassionate access anti-tumour necrosis factor-α therapy for ulcerative colitis in Australia: the benefits to patients. Internal Medicine Journal. 45: 659-66. PMID 25732268 DOI: 10.1111/imj.12732  1
2015 Parnell SR, Washington AL, Li K, Yan H, Stonaha P, Li F, Wang T, Walsh A, Chen WC, Parnell AJ, Fairclough JP, Baxter DV, Snow WM, Pynn R. Spin echo small angle neutron scattering using a continuously pumped (3)He neutron polarisation analyser. The Review of Scientific Instruments. 86: 023902. PMID 25725858 DOI: 10.1063/1.4909544  1
2015 Fry J, Casanova JP, Hamoutene D, Lush L, Walsh A, Couturier C. The impact of egg ozonation on hatching success, larval growth, and survival of atlantic cod, atlantic salmon, and rainbow trout. Journal of Aquatic Animal Health. 27: 57-64. PMID 25714943 DOI: 10.1080/08997659.2014.983278  1
2015 Hendon CH, Wittering KE, Chen TH, Kaveevivitchai W, Popov I, Butler KT, Wilson CC, Cruickshank DL, Miljani? OŠ, Walsh A. Absorbate-induced piezochromism in a porous molecular crystal. Nano Letters. 15: 2149-54. PMID 25706577 DOI: 10.1021/Acs.Nanolett.5B00144  1
2015 Walsh AJ, Cook RS, Lee JH, Arteaga CL, Skala MC. Collagen density and alignment in responsive and resistant trastuzumab-treated breast cancer xenografts. Journal of Biomedical Optics. 20: 26004. PMID 25700233 DOI: 10.1117/1.Jbo.20.2.026004  1
2015 Weiner-Gorzel K, Dempsey E, Milewska M, McGoldrick A, Toh V, Walsh A, Lindsay S, Gubbins L, Cannon A, Sharpe D, O'Sullivan J, Murphy M, Madden SF, Kell M, McCann A, et al. Overexpression of the microRNA miR-433 promotes resistance to paclitaxel through the induction of cellular senescence in ovarian cancer cells. Cancer Medicine. 4: 745-58. PMID 25684390 DOI: 10.1002/cam4.409  0.01
2015 Cannon TM, Shah AT, Walsh AJ, Skala MC. High-throughput measurements of the optical redox ratio using a commercial microplate reader. Journal of Biomedical Optics. 20: 010503. PMID 25634108 DOI: 10.1117/1.Jbo.20.1.010503  1
2015 Protesescu L, Yakunin S, Bodnarchuk MI, Krieg F, Caputo R, Hendon CH, Yang RX, Walsh A, Kovalenko MV. Nanocrystals of Cesium Lead Halide Perovskites (CsPbX₃, X = Cl, Br, and I): Novel Optoelectronic Materials Showing Bright Emission with Wide Color Gamut. Nano Letters. 15: 3692-6. PMID 25633588 DOI: 10.1021/Nl5048779  1
2015 Skelton JM, Lora da Silva E, Crespo-Otero R, Hatcher LE, Raithby PR, Parker SC, Walsh A. Electronic excitations in molecular solids: bridging theory and experiment. Faraday Discussions. 177: 181-202. PMID 25631401 DOI: 10.1039/C4Fd00168K  1
2015 Chenneville T, Clutter MO, Hintz S, Walsh A, Emmanuel P, Lujan-Zilberman J, Rodriguez C. Decisional capacity and medication adherence among youth with HIV. Aids Care. 27: 338-41. PMID 25616658 DOI: 10.1080/09540121.2014.993582  1
2015 Buckeridge J, Catlow CR, Scanlon DO, Keal TW, Sherwood P, Miskufova M, Walsh A, Woodley SM, Sokol AA. Determination of the nitrogen vacancy as a shallow compensating center in GaN doped with divalent metals. Physical Review Letters. 114: 016405. PMID 25615487 DOI: 10.1103/Physrevlett.114.016405  1
2015 Chambers MB, Wang X, Elgrishi N, Hendon CH, Walsh A, Bonnefoy J, Canivet J, Quadrelli EA, Farrusseng D, Mellot-Draznieks C, Fontecave M. Photocatalytic carbon dioxide reduction with rhodium-based catalysts in solution and heterogenized within metal-organic frameworks. Chemsuschem. 8: 603-8. PMID 25613479 DOI: 10.1002/Cssc.201403345  1
2015 Park SS, Hontz ER, Sun L, Hendon CH, Walsh A, Van Voorhis T, Dincă M. Cation-dependent intrinsic electrical conductivity in isostructural tetrathiafulvalene-based microporous metal-organic frameworks. Journal of the American Chemical Society. 137: 1774-7. PMID 25597934 DOI: 10.1021/Ja512437U  1
2015 Kitching A, Walsh A, Morgan D. Ebola in pregnancy: risk and clinical outcomes. Bjog : An International Journal of Obstetrics and Gynaecology. 122: 287. PMID 25585496 DOI: 10.1111/1471-0528.13286  1
2015 Wu EY, Walsh AR, Materne EC, Hiltner EP, Zielinski B, Miller BR, Mawby L, Modeste E, Parish CA, Barnes WM, Kermekchiev MB. A conservative isoleucine to leucine mutation causes major rearrangements and cold sensitivity in KlenTaq1 DNA polymerase. Biochemistry. 54: 881-9. PMID 25537790 DOI: 10.1021/Bi501198F  1
2015 Choo EK, Ranney ML, Chan TM, Trueger NS, Walsh AE, Tegtmeyer K, McNamara SO, Choi RY, Carroll CL. Twitter as a tool for communication and knowledge exchange in academic medicine: A guide for skeptics and novices. Medical Teacher. 37: 411-6. PMID 25523012 DOI: 10.3109/0142159X.2014.993371  1
2015 Walsh A, Scanlon DO, Chen S, Gong XG, Wei SH. Self-regulation mechanism for charged point defects in hybrid halide perovskites. Angewandte Chemie (International Ed. in English). 54: 1791-4. PMID 25504875 DOI: 10.1002/Anie.201409740  1
2015 Walsh A. The effect of social interaction on mental health nurse student learning. Nurse Education in Practice. 15: 7-12. PMID 25481983 DOI: 10.1016/j.nepr.2014.11.003  0.01
2015 Sun H, Walsh AJ, Lebel RM, Blevins G, Catz I, Lu JQ, Johnson ES, Emery DJ, Warren KG, Wilman AH. Validation of quantitative susceptibility mapping with Perls' iron staining for subcortical gray matter. Neuroimage. 105: 486-92. PMID 25462797 DOI: 10.1016/J.Neuroimage.2014.11.010  1
2015 Ghaly S, Costello S, Beswick L, Pudipeddi A, Agarwal A, Sechi A, Antoniades S, Headon B, Connor S, Lawrance IC, Sparrow M, Walsh AJ, Andrews JM. Dose tailoring of anti-tumour necrosis factor-alpha therapy delivers useful clinical efficacy in Crohn disease patients experiencing loss of response. Internal Medicine Journal. 45: 170-7. PMID 25370691 DOI: 10.1111/imj.12621  1
2015 Walsh A, Meagher-Stewart D, Macdonald M. Persistent optimizing: how mothers make food choices for their preschool children. Qualitative Health Research. 25: 527-39. PMID 25258336 DOI: 10.1177/1049732314552456  1
2015 Zyoud SH, Al-Jabi SW, Nabulsi MM, Tubaila MF, Sweileh WM, Awang R, Walsh A. The Validity and Reliability of the Parent Fever Management Scale: A Study from Palestine. Maternal and Child Health Journal. 19: 1890-7. PMID 24880253 DOI: 10.1007/s10995-014-1529-5  0.01
2015 Crema AS, Walsh A, Yamane IS, Ventura BV, Santhiago MR. Femtosecond laser-assisted cataract surgery in patients with Marfan syndrome and subluxated lens Journal of Refractive Surgery. 31: 338-341. DOI: 10.3928/1081597X-20150424-02  1
2015 Brennan SA, Fhoghlú CN, DeVitt BM, O'Mahony FJ, Brabazon D, Walsh A. Instructional review: General orthopaedics silver nanoparticles and their orthopaedic applications Bone and Joint Journal. 97: 582-589. DOI: 10.1302/0301-620X.97B5.33336  1
2015 Walsh A, Tsilimpounidi M. Virtues of violence: A testimonial performance, or an affidavit of lies, excuses, and justifications Cultural Studies - Critical Methodologies. 15: 180-189. DOI: 10.1177/1532708614562883  0.01
2015 Walsh A, Meagher-Stewart D, Macdonald M. Persistent optimizing: How mothers make food choices for their preschool children Qualitative Health Research. 25: 527-539. DOI: 10.1177/1049732314552456  1
2015 Walsh A. Lost and/or left behind in a Malagasy outpost of the ‘underworld of gemstones’ Critique of Anthropology. 35: 30-46. DOI: 10.1177/0308275X14557094  0.01
2015 Walsh AK, Hand M, Kelsey DE. A metamorphic perspective on foreland flexure during intraplate orogeny: Evidence for the involvement of weak lithosphere Terra Nova. DOI: 10.1111/ter.12164  0.01
2015 Walsh A, Forbes JR. Modeling and Control of Flexible Telescoping Manipulators Ieee Transactions On Robotics. DOI: 10.1109/Tro.2015.2441473  1
2015 Walsh A. Are new mental nurses prepared for practice? Mental Health Review Journal. 20: 119-130. DOI: 10.1108/MHRJ-10-2014-0040  0.01
2015 Celuch K, Robinson NM, Walsh AM. A framework for encouraging retail customer feedback Journal of Services Marketing. 29: 280-292. DOI: 10.1108/JSM-02-2014-0062  1
2015 Buckeridge J, Catlow CRA, Scanlon DO, Keal TW, Sherwood P, Miskufova M, Walsh A, Woodley SM, Sokol AA. Buckeridge et al. Reply Physical Review Letters. 115. DOI: 10.1103/PhysRevLett.115.029702  1
2015 Buckeridge J, Catlow CRA, Scanlon DO, Keal TW, Sherwood P, Miskufova M, Walsh A, Woodley SM, Sokol AA. Determination of the nitrogen vacancy as a shallow compensating center in GaN doped with divalent metals Physical Review Letters. 114. DOI: 10.1103/PhysRevLett.114.016405  1
2015 Brivio F, Frost JM, Skelton JM, Jackson AJ, Weber OJ, Weller MT, Goñi AR, Leguy AMA, Barnes PRF, Walsh A. Lattice dynamics and vibrational spectra of the orthorhombic, tetragonal, and cubic phases of methylammonium lead iodide Physical Review B - Condensed Matter and Materials Physics. 92. DOI: 10.1103/Physrevb.92.144308  1
2015 Da Silva EL, Skelton JM, Parker SC, Walsh A. Phase stability and transformations in the halide perovskite CsSnI3 Physical Review B - Condensed Matter and Materials Physics. 91. DOI: 10.1103/Physrevb.91.144107  1
2015 Kim CE, Tak YJ, Butler KT, Walsh A, Soon A. Lattice-mismatched heteroepitaxy of IV-VI thin films on PbTe(001): An ab initio study Physical Review B - Condensed Matter and Materials Physics. 91. DOI: 10.1103/Physrevb.91.085307  1
2015 Krishnan V, Ellingsen SP, Reid MJ, Brunthaler A, Sanna A, McCallum J, Reynolds C, Bignall HE, Phillips CJ, Dodson R, Rioja M, Caswell JL, Chen X, Dawson JR, Fujisawa K, ... ... Walsh AJ, et al. First parallax measurements toward a 6.7 GHZ methanol maser with the Australian long baseline array - Distance to G 339.884-1.259. Astrophysical Journal. 805. DOI: 10.1088/0004-637X/805/2/129  1
2015 Rathborne JM, Longmore SN, Jackson JM, Alves JF, Bally J, Bastian N, Contreras Y, Foster JB, Garay G, Kruijssen JMD, Testi L, Walsh AJ. A cluster in the making: ALMA reveals the initial conditions for high-mass cluster formation Astrophysical Journal. 802. DOI: 10.1088/0004-637X/802/2/125  1
2015 Walsh A, Wright JP. Biosocial criminology and its discontents: a critical realist philosophical analysis Criminal Justice Studies. 28: 124-140. DOI: 10.1080/1478601X.2015.1006862  1
2015 Walsh A. Gerald Brenan: Hispanophile or Hispanophobe? A Critical Re-reading of The Face of Spain Bulletin of Spanish Studies. DOI: 10.1080/14753820.2014.985142  0.01
2015 Fry J, Casanova JP, Hamoutene D, Lush L, Walsh A, Couturier C. The impact of egg ozonation on hatching success, larval growth, and survival of atlantic cod, atlantic salmon, and rainbow trout Journal of Aquatic Animal Health. 27: 57-64. DOI: 10.1080/08997659.2014.983278  1
2015 Butler KT, Crespo-Otero R, Buckeridge J, Scanlon DO, Bovill E, Lidzey D, Walsh A. Band energy control of molybdenum oxide by surface hydration Applied Physics Letters. 107. DOI: 10.1063/1.4937460  1
2015 Kim CE, Skelton JM, Walsh A, Soon A. Solid-state chemistry of glassy antimony oxides Journal of Materials Chemistry C. 3: 11349-11356. DOI: 10.1039/C5Tc02191J  1
2015 Burton LA, Whittles TJ, Hesp D, Linhart WM, Skelton JM, Hou B, Webster RF, O'Dowd G, Reece C, Cherns D, Fermin DJ, Veal TD, Dhanak VR, Walsh A. Electronic and optical properties of single crystal SnS2: An earth-abundant disulfide photocatalyst Journal of Materials Chemistry A. 4: 1312-1318. DOI: 10.1039/C5Ta08214E  1
2015 Hendon CH, Walsh A. Chemical principles underpinning the performance of the metal-organic framework HKUST-1 Chemical Science. 6: 3674-3683. DOI: 10.1039/c5sc01489a  1
2015 Hendon CH, Yang RX, Burton LA, Walsh A. Assessment of polyanion (BF4- and PF6-) substitutions in hybrid halide perovskites Journal of Materials Chemistry A. 3: 9067-9070. DOI: 10.1039/C4Ta05284F  1
2015 Butler KT, Frost JM, Walsh A. Band alignment of the hybrid halide perovskites CH3NH3PbCl3, CH3NH3PbBr3 and CH3NH3PbI3 Materials Horizons. 2: 228-231. DOI: 10.1039/C4Mh00174E  1
2015 Butler KT, Frost JM, Walsh A. Ferroelectric materials for solar energy conversion: Photoferroics revisited Energy and Environmental Science. 8: 838-848. DOI: 10.1039/C4Ee03523B  1
2015 Skelton JM, Crespo-Otero R, Hatcher LE, Parker SC, Raithby PR, Walsh A. Energetics, thermal isomerisation and photochemistry of the linkage-isomer system [Ni(Et4dien)(η2-O,ON)(η1-NO2)] Crystengcomm. 17: 383-394. DOI: 10.1039/C4Ce01411A  1
2015 Grancini G, Srimath Kandada AR, Frost JM, Barker AJ, de Bastiani M, Gandini M, Marras S, Lanzani G, Walsh A, Petrozza A. Role of microstructure in the electron–hole interaction of hybrid lead halide perovskites Nature Photonics. DOI: 10.1038/nphoton.2015.151  1
2015 Leguy AMA, Frost JM, McMahon AP, Sakai VG, Kochelmann W, Law C, Li X, Foglia F, Walsh A, O'Regan BC, Nelson J, Cabral JT, Barnes PRF. The dynamics of methylammonium ions in hybrid organic-inorganic perovskite solar cells Nature Communications. 6. DOI: 10.1038/ncomms8124  1
2015 Protesescu L, Yakunin S, Bodnarchuk MI, Krieg F, Caputo R, Hendon CH, Yang RX, Walsh A, Kovalenko MV. Nanocrystals of Cesium Lead Halide Perovskites (CsPbX3, X = Cl, Br, and I): Novel Optoelectronic Materials Showing Bright Emission with Wide Color Gamut Nano Letters. 15: 3692-3696. DOI: 10.1021/nl5048779  1
2015 Walsh A. Principles of chemical bonding and band gap engineering in hybrid organic-inorganic halide perovskites Journal of Physical Chemistry C. 119: 5755-5760. DOI: 10.1021/jp512420b  0.01
2015 Sun L, Hendon CH, Minier MA, Walsh A, Dincə M. Million-fold electrical conductivity enhancement in Fe2(DEBDC) versus Mn2(DEBDC) (E = S, O) Journal of the American Chemical Society. 137: 6164-6167. DOI: 10.1021/jacs.5b02897  1
2015 Park SS, Hontz ER, Sun L, Hendon CH, Walsh A, Van Voorhis T, Dincə M. Cation-dependent intrinsic electrical conductivity in isostructural tetrathiafulvalene-based microporous metal-organic frameworks Journal of the American Chemical Society. 137: 1774-1777. DOI: 10.1021/ja512437u  1
2015 Bakulin AA, Selig O, Bakker HJ, Rezus YLA, Müller C, Glaser T, Lovrincic R, Sun Z, Chen Z, Walsh A, Frost JM, Jansen TLC. Real-Time Observation of Organic Cation Reorientation in Methylammonium Lead Iodide Perovskites Journal of Physical Chemistry Letters. 6: 3663-3669. DOI: 10.1021/acs.jpclett.5b01555  1
2015 Weller MT, Weber OJ, Frost JM, Walsh A. Cubic Perovskite Structure of Black Formamidinium Lead Iodide, α-[HC(NH2)2]PbI3, at 298 K Journal of Physical Chemistry Letters. 6: 3209-3212. DOI: 10.1021/Acs.Jpclett.5B01432  1
2015 Crespo-Otero R, Walsh A. Variation in surface ionization potentials of pristine and hydrated BiVO4 Journal of Physical Chemistry Letters. 6: 2379-2383. DOI: 10.1021/acs.jpclett.5b00966  1
2015 Buckeridge J, Butler KT, Catlow CRA, Logsdail AJ, Scanlon DO, Shevlin SA, Woodley SM, Sokol AA, Walsh A. Polymorph Engineering of TiO2: Demonstrating How Absolute Reference Potentials Are Determined by Local Coordination Chemistry of Materials. 27: 3844-3851. DOI: 10.1021/Acs.Chemmater.5B00230  1
2015 Braiding C, Burton MG, Blackwell R, Glück C, Hawkes J, Kulesa C, Maxted N, Rebolledo D, Rowell G, Stark A, Tothill N, Urquhart JS, Voisin F, Walsh AJ, de Wilt P, et al. The Mopra Southern Galactic Plane CO Survey — Data Release 1 Publications of the Astronomical Society of Australia. DOI: 10.1017/Pasa.2015.20  1
2015 Walsh A. The effect of social interaction on mental health nurse student learning Nurse Education in Practice. 15: 7-12. DOI: 10.1016/j.nepr.2014.11.003  0.01
2015 Koehler SM, Walsh A, Lovy AJ, Pruzansky JS, Shukla DR, Hausman MR. Outcomes of arthroscopic treatment of osteochondritis dissecans of the capitellum and description of the technique Journal of Shoulder and Elbow Surgery. DOI: 10.1016/j.jse.2015.06.013  1
2015 Walsh A, Finn J, Jebb M, Waldren S, Sullivan C. The distribution of vascular plant species of conservation concern in Ireland, and their coincidence with designated areas Journal For Nature Conservation. 24: 56-62. DOI: 10.1016/j.jnc.2015.01.007  0.01
2015 Walsh AEL, Harmer CJ. The cognitive neuropsychological model of antidepressant response Current Opinion in Psychology. 4: 124-130. DOI: 10.1016/j.copsyc.2014.12.022  0.01
2015 Barlow KE, Briggs PA, Haysom KA, Hutson AM, Lechiara NL, Racey PA, Walsh AL, Langton SD. Citizen science reveals trends in bat populations: The National Bat Monitoring Programme in Great Britain Biological Conservation. 182: 14-26. DOI: 10.1016/j.biocon.2014.11.022  1
2015 Fencl JL, Walsh A, Vocke D. The Bariatric Patient: An Overview of Perioperative Care Aorn Journal. 102: 116-131. DOI: 10.1016/j.aorn.2015.05.007  1
2015 Walsh A. Compensation for Blood Plasma Donation as a Distinctive Ethical Hazard: Reformulating the Commodification Objection Hec Forum. DOI: 10.1007/s10730-015-9287-3  0.01
2015 Walsh AJ, Shah AT, Sharick JT, Skala MC. Fluorescence lifetime measurements of nad(p)h in live cells and tissue Springer Series in Chemical Physics. 111: 435-456. DOI: 10.1007/978-3-319-14929-5_14  1
2015 Josefson M, Walsh A, Abrahamsson K. Imaging and identification of marine algal bioactive compounds by surface enhanced Raman spectroscopy (SERS) Methods in Molecular Biology. 1308: 365-374. DOI: 10.1007/978-1-4939-2684-8_23  1
2015 Cobzas D, Sun H, Walsh AJ, Lebel RM, Blevins G, Wilman AH. Subcortical gray matter segmentation and voxel-based analysis using transverse relaxation and quantitative susceptibility mapping with application to multiple sclerosis Journal of Magnetic Resonance Imaging. DOI: 10.1002/jmri.24951  1
2015 Chambers MB, Wang X, Elgrishi N, Hendon CH, Walsh A, Bonnefoy J, Canivet J, Quadrelli EA, Farrusseng D, Mellot-Draznieks C, Fontecave M. Photocatalytic carbon dioxide reduction with rhodiumbased catalysts in solution and heterogenized within metal-organic frameworks Chemsuschem. 8: 603-608. DOI: 10.1002/cssc.201403345  1
2015 Murray AT, Dowley MJH, Pradaux-Caggiano F, Baldansuren A, Fielding AJ, Tuna F, Hendon CH, Walsh A, Lloyd-Jones GC, John MP, Carbery DR. Catalytic Amine Oxidation under Ambient Aerobic Conditions: Mimicry of Monoamine Oxidase B Angewandte Chemie - International Edition. 54: 8997-9000. DOI: 10.1002/anie.201503654  1
2015 Walsh A, Scanlon DO, Chen S, Gong XG, Wei SH. Self-regulation mechanism for charged point defects in hybrid halide perovskites Angewandte Chemie - International Edition. 54: 1791-1794. DOI: 10.1002/anie.201409740  1
2014 Walsh A. Building bridges: the World Organization of Family Doctors' work in education. Education For Primary Care : An Official Publication of the Association of Course Organisers, National Association of Gp Tutors, World Organisation of Family Doctors. 25: 243-7. PMID 25625829  0.01
2014 Bristow JK, Tiana D, Walsh A. Transferable Force Field for Metal-Organic Frameworks from First-Principles: BTW-FF. Journal of Chemical Theory and Computation. 10: 4644-4652. PMID 25574157 DOI: 10.1021/Ct500515H  1
2014 Walsh A, Vaillancourt R, Pouliot A. Increasing public awareness of Ebola virus disease symptoms using a pictogram-based poster. Canadian Journal of Public Health = Revue Canadienne De Santé Publique. 105: e466. PMID 25560898  1
2014 Padmanaban S, Warren S, Walsh A, Partridge M, Hawkins MA. Comparison of Acuros (AXB) and Anisotropic Analytical Algorithm (AAA) for dose calculation in treatment of oesophageal cancer: effects on modelling tumour control probability. Radiation Oncology (London, England). 9: 286. PMID 25533761 DOI: 10.1186/s13014-014-0286-3  1
2014 Walsh AL, Considine SW, Thomas AZ, Lynch TH, Manecksha RP. Digital rectal examination in primary care is important for early detection of prostate cancer: a retrospective cohort analysis study. The British Journal of General Practice : the Journal of the Royal College of General Practitioners. 64: e783-7. PMID 25452543 DOI: 10.3399/bjgp14X682861  1
2014 Butler KT, Hendon CH, Walsh A. Electronic structure modulation of metal-organic frameworks for hybrid devices. Acs Applied Materials & Interfaces. 6: 22044-50. PMID 25436990 DOI: 10.1021/Am507016R  1
2014 Woodall CH, Fuertes S, Beavers CM, Hatcher LE, Parlett A, Shepherd HJ, Christensen J, Teat SJ, Intissar M, Rodrigue-Witchel A, Suffren Y, Reber C, Hendon CH, Tiana D, Walsh A, et al. Tunable trimers: using temperature and pressure to control luminescent emission in gold(I) pyrazolate-based trimers. Chemistry (Weinheim An Der Bergstrasse, Germany). 20: 16933-42. PMID 25331304 DOI: 10.1002/Chem.201404058  1
2014 Yacoub HA, Walsh AL, Pineda CC. Cardioembolic stroke secondary to Lambl's excrescence on the aortic valve: a case report. Journal of Vascular and Interventional Neurology. 7: 23-5. PMID 25298855  0.12
2014 Tiana D, Hendon CH, Walsh A. Ligand design for long-range magnetic order in metal-organic frameworks. Chemical Communications (Cambridge, England). 50: 13990-3. PMID 25266671 DOI: 10.1039/C4Cc06433J  1
2014 Heap GA, Weedon MN, Bewshea CM, Singh A, Chen M, Satchwell JB, Vivian JP, So K, Dubois PC, Andrews JM, Annese V, Bampton P, Barnardo M, Bell S, Cole A, ... ... Walsh A, et al. HLA-DQA1-HLA-DRB1 variants confer susceptibility to pancreatitis induced by thiopurine immunosuppressants. Nature Genetics. 46: 1131-4. PMID 25217962 DOI: 10.1038/ng.3093  1
2014 Suntharalingam G, Handy J, Walsh A. Regionalisation of critical care: can we sustain an intensive care unit in every hospital? Anaesthesia. 69: 1069-73. PMID 25204233 DOI: 10.1111/anae.12810  0.01
2014 Walsh AJ, Cook RS, Sanders ME, Aurisicchio L, Ciliberto G, Arteaga CL, Skala MC. Quantitative optical imaging of primary tumor organoid metabolism predicts drug response in breast cancer. Cancer Research. 74: 5184-94. PMID 25100563 DOI: 10.1158/0008-5472.Can-14-0663  1
2014 Robinson C, Alfonso H, Woo S, Walsh A, Olsen N, Musk AW, Robinson BW, Nowak AK, Lake RA. Statins do not alter the incidence of mesothelioma in asbestos exposed mice or humans. Plos One. 9: e103025. PMID 25093718 DOI: 10.1371/journal.pone.0103025  1
2014 Senturk S, Yao Z, Camiolo M, Stiles B, Rathod T, Walsh AM, Nemajerova A, Lazzara MJ, Altorki NK, Krainer A, Moll UM, Lowe SW, Cartegni L, Sordella R. p53Ψ is a transcriptionally inactive p53 isoform able to reprogram cells toward a metastatic-like state. Proceedings of the National Academy of Sciences of the United States of America. 111: E3287-96. PMID 25074920 DOI: 10.1073/Pnas.1321640111  1
2014 Devonshire IM, Davis J, Fairweather S, Highfield L, Thaker C, Walsh A, Wilson R, Hathway GJ. Risk-based learning games improve long-term retention of information among school pupils. Plos One. 9: e103640. PMID 25072799 DOI: 10.1371/Journal.Pone.0103640  1
2014 McCormack DR, Walsh AJ, Sit W, Arteaga CL, Chen J, Cook RS, Skala MC. In vivo hyperspectral imaging of microvessel response to trastuzumab treatment in breast cancer xenografts. Biomedical Optics Express. 5: 2247-61. PMID 25071962 DOI: 10.1364/Boe.5.002247  1
2014 Dent N, Deconinck H, Golden K, Brown R, Walsh A. Information-sharing to improve learning about community-based management of acute malnutrition (CMAM) and its impact. Food and Nutrition Bulletin. 35: S86-9. PMID 25069299  0.01
2014 Ellis L, Hoskin A, Hartley R, Walsh A, Widmayer A, Ratnasingam M. General Theory versus ENA Theory: Comparing Their Predictive Accuracy and Scope. International Journal of Offender Therapy and Comparative Criminology. PMID 25063685 DOI: 10.1177/0306624X14543263  1
2014 McDonnell EC, Heussen FM, Ruiz-Garcia H, Ouyang Y, Narala R, Walsh AC, Sadda SR. Effect of anti-VEGF treatment on choroidal thickness over time in patients with neovascular age-related macular degeneration. European Journal of Ophthalmology. 24: 897-903. PMID 25044137 DOI: 10.5301/ejo.5000509  0.08
2014 Segal-Gidan F, Walsh A, Lie D, Fung CC, Lohenry K. Knowledge and attitude change in physician assistant students after an interprofessional geriatric care experience: a mixed methods study. The Journal of Physician Assistant Education : the Official Journal of the Physician Assistant Education Association. 25: 25-30. PMID 25016910 DOI: 10.1097/01367895-201425020-00006  0.04
2014 Crema AS, Walsh A, Ventura BV, Santhiago MR. Visual outcomes of eyes implanted with a toric multifocal intraocular lens. Journal of Refractive Surgery (Thorofare, N.J. : 1995). 30: 486-91. PMID 24983831 DOI: 10.3928/1081597X-20140530-02  1
2014 Walsh A, Palmer R, Travis S. Mucosal healing as a target of therapy for colonic inflammatory bowel disease and methods to score disease activity. Gastrointestinal Endoscopy Clinics of North America. 24: 367-78. PMID 24975528 DOI: 10.1016/j.giec.2014.03.005  1
2014 Raiser S, Davidson K, Walsh A, Egerman R. Septic arthritis of the shoulder complicating pregnancy. Case Reports in Obstetrics and Gynecology. 2014: 738153. PMID 24959364 DOI: 10.1155/2014/738153  0.01
2014 Walsh A, Moore A, Barber A, Opsteen J. Educational role of nurse practitioners in a family practice centre: perspectives of learners and nurses. Canadian Family Physician MéDecin De Famille Canadien. 60: e316, e318-21. PMID 24925966  0.01
2014 Walsh AL, Tuzova AV, Bolton EM, Lynch TH, Perry AS. Long noncoding RNAs and prostate carcinogenesis: the missing 'linc'? Trends in Molecular Medicine. 20: 428-36. PMID 24836411 DOI: 10.1016/j.molmed.2014.03.005  1
2014 Frost JM, Butler KT, Brivio F, Hendon CH, van Schilfgaarde M, Walsh A. Atomistic origins of high-performance in hybrid halide perovskite solar cells. Nano Letters. 14: 2584-90. PMID 24684284 DOI: 10.1021/Nl500390F  1
2014 Shah AT, Demory Beckler M, Walsh AJ, Jones WP, Pohlmann PR, Skala MC. Optical metabolic imaging of treatment response in human head and neck squamous cell carcinoma. Plos One. 9: e90746. PMID 24595244 DOI: 10.1371/Journal.Pone.0090746  1
2014 Tiana D, Hendon CH, Walsh A, Vaid TP. Computational screening of structural and compositional factors for electrically conductive coordination polymers. Physical Chemistry Chemical Physics : Pccp. 16: 14463-72. PMID 24569694 DOI: 10.1039/C4Cp00008K  1
2014 Butler KT, Hendon CH, Walsh A. Electronic chemical potentials of porous metal-organic frameworks. Journal of the American Chemical Society. 136: 2703-6. PMID 24447027 DOI: 10.1021/Ja4110073  1
2014 Walsh A, Butler KT. Prediction of electron energies in metal oxides. Accounts of Chemical Research. 47: 364-72. PMID 24066925 DOI: 10.1021/Ar400115X  1
2014 Li C, Winzer T, Walsh A, Yan B, Stampfl C, Soon A. Stacking-dependent energetics and electronic structure of ultrathin polymorphic V2 VI3 topological insulator nanofilms Physical Review B - Condensed Matter and Materials Physics. 90. DOI: 10.1103/Physrevb.90.075438  1
2014 Skelton JM, Parker SC, Togo A, Tanaka I, Walsh A. Thermal physics of the lead chalcogenides PbS, PbSe, and PbTe from first principles Physical Review B - Condensed Matter and Materials Physics. 89. DOI: 10.1103/Physrevb.89.205203  1
2014 Buckeridge J, Scanlon DO, Veal TD, Ashwin MJ, Walsh A, Catlow CRA. N incorporation and associated localized vibrational modes in GaSb Physical Review B - Condensed Matter and Materials Physics. 89. DOI: 10.1103/Physrevb.89.014107  1
2014 Yoo SH, Butler KT, Soon A, Abbas A, Walls JM, Walsh A. Identification of critical stacking faults in thin-film CdTe solar cells Applied Physics Letters. 105. DOI: 10.1063/1.4892844  1
2014 Frost JM, Butler KT, Walsh A. Molecular ferroelectric contributions to anomalous hysteresis in hybrid perovskite solar cells Apl Materials. 2. DOI: 10.1063/1.4890246  1
2014 Banai RE, Burton LA, Choi SG, Hofherr F, Sorgenfrei T, Walsh A, To B, Cröll A, Brownson JRS. Ellipsometric characterization and density-functional theory analysis of anisotropic optical properties of single-crystal α-SnS Journal of Applied Physics. 116. DOI: 10.1063/1.4886915  1
2014 Sallis S, Butler KT, Quackenbush NF, Williams DS, Junda M, Fischer DA, Woicik JC, Podraza NJ, White BE, Walsh A, Piper LFJ. Origin of deep subgap states in amorphous indium gallium zinc oxide: Chemically disordered coordination of oxygen Applied Physics Letters. 104. DOI: 10.1063/1.4883257  1
2014 Shibuya T, Goto Y, Kamihara Y, Matoba M, Yasuoka K, Burton LA, Walsh A. From kesterite to stannite photovoltaics: Stability and band gaps of the Cu2(Zn,Fe)SnS4 alloy Applied Physics Letters. 104. DOI: 10.1063/1.4862030  1
2014 Jackson AJ, Walsh A. Abinitio thermodynamic model of Cu2ZnSnS4 Journal of Materials Chemistry A. 2: 7829-7836. DOI: 10.1039/C4Ta00892H  1
2014 Bristow JK, Tiana D, Parker SC, Walsh A. Defect chemistry of Ti and Fe impurities and aggregates in Al 2O3 Journal of Materials Chemistry A. 2: 6198-6208. DOI: 10.1039/C3Ta15322C  1
2014 Yoo SH, Walsh A, Scanlon DO, Soon A. Electronic structure and band alignment of zinc nitride, Zn 3N2 Rsc Advances. 4: 3306-3311. DOI: 10.1039/C3Ra46558F  1
2014 Wang C, Chen S, Yang JH, Lang L, Xiang HJ, Gong XG, Walsh A, Wei SH. Design of I2-II-IV-VI4 semiconductors through element substitution: The thermodynamic stability limit and chemical trend Chemistry of Materials. 26: 3411-3417. DOI: 10.1021/Cm500598X  1
2014 Buckeridge J, Scanlon DO, Walsh A, Catlow CRA. Automated procedure to determine the thermodynamic stability of a material and the range of chemical potentials necessary for its formation relative to competing phases and compounds Computer Physics Communications. 185: 330-338. DOI: 10.1016/J.Cpc.2013.08.026  1
2013 Buckeridge J, Bromley ST, Walsh A, Woodley SM, Catlow CR, Sokol AA. One-dimensional embedded cluster approach to modeling CdS nanowires. The Journal of Chemical Physics. 139: 124101. PMID 24089744 DOI: 10.1063/1.4820415  1
2013 Hendon CH, Tiana D, Fontecave M, Sanchez C, D'arras L, Sassoye C, Rozes L, Mellot-Draznieks C, Walsh A. Engineering the optical response of the titanium-MIL-125 metal-organic framework through ligand functionalization. Journal of the American Chemical Society. 135: 10942-5. PMID 23841821 DOI: 10.1021/Ja405350U  1
2013 Scanlon DO, Dunnill CW, Buckeridge J, Shevlin SA, Logsdail AJ, Woodley SM, Catlow CR, Powell MJ, Palgrave RG, Parkin IP, Watson GW, Keal TW, Sherwood P, Walsh A, Sokol AA. Band alignment of rutile and anatase TiOâ‚‚. Nature Materials. 12: 798-801. PMID 23832124 DOI: 10.1038/Nmat3697  1
2013 Bristow JK, Parker SC, Catlow CR, Woodley SM, Walsh A. Microscopic origin of the optical processes in blue sapphire. Chemical Communications (Cambridge, England). 49: 5259-61. PMID 23632734 DOI: 10.1039/C3Cc41506F  1
2013 Chen S, Walsh A, Gong XG, Wei SH. Classification of lattice defects in the kesterite Cu2ZnSnS4 and Cu2ZnSnSe4 earth-abundant solar cell absorbers. Advanced Materials (Deerfield Beach, Fla.). 25: 1522-39. PMID 23401176 DOI: 10.1002/Adma.201203146  1
2013 Liu HR, Yang JH, Zhang YY, Chen S, Walsh A, Xiang H, Gong X, Wei SH. Prediction of (TiO2)x(Cu2O)y alloys for efficient photoelectrochemical water splitting. Physical Chemistry Chemical Physics : Pccp. 15: 1778-81. PMID 23258482 DOI: 10.1039/C2Cp44484D  1
2013 Walsh A, Kehoe AB, Temple DJ, Watson GW, Scanlon DO. PbO2: from semi-metal to transparent conducting oxide by defect chemistry control. Chemical Communications (Cambridge, England). 49: 448-50. PMID 23205392 DOI: 10.1039/C2Cc35928F  1
2013 Woodall CH, Christensen J, Walsh A, Beavers C, Raithby P. There and back again: polytypism and high-pressure re-entrant behaviour in a gold(I) trimer Acta Crystallographica Section A. 69. DOI: 10.1107/S0108767313094750  1
2013 Jackson AJ, Walsh A. Oxidation of GaN: An ab initio thermodynamic approach Physical Review B - Condensed Matter and Materials Physics. 88. DOI: 10.1103/Physrevb.88.165201  1
2013 Walsh A, Scanlon DO. Polymorphism of indium oxide: Materials physics of orthorhombic In 2O3 Physical Review B - Condensed Matter and Materials Physics. 88. DOI: 10.1103/Physrevb.88.161201  1
2013 Buckeridge J, Scanlon DO, Walsh A, Catlow CRA, Sokol AA. Dynamical response and instability in ceria under lattice expansion Physical Review B - Condensed Matter and Materials Physics. 87. DOI: 10.1103/Physrevb.87.214304  1
2013 Brivio F, Walker AB, Walsh A. Structural and electronic properties of hybrid perovskites for high-efficiency thin-film photovoltaics from first-principles Apl Materials. 1. DOI: 10.1063/1.4824147  1
2013 Burton LA, Walsh A. Band alignment in SnS thin-film solar cells: Possible origin of the low conversion efficiency Applied Physics Letters. 102. DOI: 10.1063/1.4801313  1
2013 Walsh A, Scanlon DO. Electron excess in alkaline earth sub-nitrides: 2D electron gas or 3D electride? Journal of Materials Chemistry C. 1: 3525-3528. DOI: 10.1039/C3Tc30690A  1
2013 Hendon CH, Tiana D, Murray AT, Carbery DR, Walsh A. Helical frontier orbitals of conjugated linear molecules Chemical Science. 4: 4278-4284. DOI: 10.1039/C3Sc52061G  1
2013 Hendon CH, Tiana D, Vaid TP, Walsh A. Thermodynamic and electronic properties of tunable II-VI and IV-VI semiconductor based metal-organic frameworks from computational chemistry Journal of Materials Chemistry C. 1: 95-100. DOI: 10.1039/C2Tc00108J  1
2013 Walsh A, Kehoe AB, Temple DJ, Watson GW, Scanlon DO. PbO2: From semi-metal to transparent conducting oxide by defect chemistry control Chemical Communications. 49: 448-450. DOI: 10.1039/c2cc35928f  1
2013 Allen JP, Carey JJ, Walsh A, Scanlon DO, Watson GW. Electronic structures of antimony oxides Journal of Physical Chemistry C. 117: 14759-14769. DOI: 10.1021/Jp4026249  1
2013 Burton LA, Colombara D, Abellon RD, Grozema FC, Peter LM, Savenije TJ, Dennler G, Walsh A. Synthesis, characterization, and electronic structure of single-crystal SnS, Sn2S3, and SnS2 Chemistry of Materials. 25: 4908-4916. DOI: 10.1021/Cm403046M  1
2013 Walsh A, Buckeridge J, Catlow CRA, Jackson AJ, Keal TW, Miskufova M, Sherwood P, Shevlin SA, Watkins MB, Woodley SM, Sokol AA. Limits to doping of wide band gap semiconductors Chemistry of Materials. 25: 2924-2926. DOI: 10.1021/Cm402237S  1
2013 Lunt RA, Jackson AJ, Walsh A. Dielectric response of Fe2O3 crystals and thin films Chemical Physics Letters. 586: 67-69. DOI: 10.1016/J.Cplett.2013.09.023  1
2012 Hendon CH, Tiana D, Walsh A. Conductive metal-organic frameworks and networks: fact or fantasy? Physical Chemistry Chemical Physics : Pccp. 14: 13120-32. PMID 22858739 DOI: 10.1039/C2Cp41099K  1
2012 Dufton JT, Walsh A, Panchmatia PM, Peter LM, Colombara D, Islam MS. Structural and electronic properties of CuSbS2 and CuBiS2: potential absorber materials for thin-film solar cells. Physical Chemistry Chemical Physics : Pccp. 14: 7229-33. PMID 22514020 DOI: 10.1039/C2Cp40916J  1
2012 Turner DL, Stone KH, Stephens PW, Walsh A, Singh MP, Vaid TP. Synthesis, characterization, and calculated electronic structure of the crystalline metal-organic polymers [Hg(SC6H4S)(en)]n and [Pb(SC6H4S)(dien)]n. Inorganic Chemistry. 51: 370-6. PMID 22136165 DOI: 10.1021/Ic201779A  1
2012 Shin D, Foord JS, Egdell RG, Walsh A. Electronic structure of CuCrO2 thin films grown on Al 2O3(001) by oxygen plasma assisted molecular beam epitaxy Journal of Applied Physics. 112. DOI: 10.1063/1.4768726  1
2012 Chen S, Wang LW, Walsh A, Gong XG, Wei SH. Abundance of CuZn+ SnZn and 2CuZn +Sn Zn defect clusters in kesterite solar cells Applied Physics Letters. 101. DOI: 10.1063/1.4768215  1
2012 Scanlon DO, Walsh A. Bandgap engineering of ZnSnP 2 for high-efficiency solar cells Applied Physics Letters. 100. DOI: 10.1063/1.4730375  1
2012 Walsh A, Catlow CRA, Galvelis R, Scanlon DO, Schiffmann F, Sokol AA, Woodley SM. Prediction on the existence and chemical stability of cuprous fluoride Chemical Science. 3: 2565-2569. DOI: 10.1039/C2Sc20321A  1
2012 Battle PD, Sviridov LA, Woolley RJ, Grandjean F, Long GJ, Catlow CRA, Sokol AA, Walsh A, Woodley SM. Magnetic properties of Fe 2GeMo 3N; An experimental and computational study Journal of Materials Chemistry. 22: 15606-15613. DOI: 10.1039/C2Jm32574H  1
2012 Pussi K, Matilainen A, Dhanak VR, Walsh A, Egdell RG, Zhang KHL. Surface structure of In2O3(111) (1 × 1) determined by density functional theory calculations and low energy electron diffraction Surface Science. 606: 1-6. DOI: 10.1016/J.Susc.2011.07.014  1
2012 Maniopoulou A, Davidson ERM, Grau-Crespo R, Walsh A, Bush IJ, Catlow CRA, Woodley SM. Introducing k-point parallelism into VASP Computer Physics Communications. 183: 1696-1701. DOI: 10.1016/J.Cpc.2012.03.009  1
2012 Walsh A, Chen S, Wei SH, Gong XG. Kesterite thin-film solar cells: Advances in materials modelling of Cu 2 ZnSnS 4 Advanced Energy Materials. 2: 400-409. DOI: 10.1002/Aenm.201100630  1
2011 Scanlon DO, Kehoe AB, Watson GW, Jones MO, David WI, Payne DJ, Egdell RG, Edwards PP, Walsh A. Nature of the band gap and origin of the conductivity of PbO2 revealed by theory and experiment. Physical Review Letters. 107: 246402. PMID 22243014 DOI: 10.1103/Physrevlett.107.246402  1
2011 Walsh A, Catlow CR, Miskufova M, Sokol AA. Electron and hole stability in GaN and ZnO. Journal of Physics. Condensed Matter : An Institute of Physics Journal. 23: 334217. PMID 21813955 DOI: 10.1088/0953-8984/23/33/334217  1
2011 Catlow R, Walsh A. Semiconducting oxides. Journal of Physics. Condensed Matter : An Institute of Physics Journal. 23: 330301. PMID 21813952 DOI: 10.1088/0953-8984/23/33/330301  0.01
2011 Zhang KH, Lazarov VK, Veal TD, Oropeza FE, McConville CF, Egdell RG, Walsh A. Thickness dependence of the strain, band gap and transport properties of epitaxial In2O3 thin films grown on Y-stabilised ZrO2(111). Journal of Physics. Condensed Matter : An Institute of Physics Journal. 23: 334211. PMID 21813945 DOI: 10.1088/0953-8984/23/33/334211  1
2011 Walsh A, Da Silva JL, Wei SH. Multi-component transparent conducting oxides: progress in materials modelling. Journal of Physics. Condensed Matter : An Institute of Physics Journal. 23: 334210. PMID 21813942 DOI: 10.1088/0953-8984/23/33/334210  1
2011 Walsh A, Payne DJ, Egdell RG, Watson GW. Stereochemistry of post-transition metal oxides: revision of the classical lone pair model. Chemical Society Reviews. 40: 4455-63. PMID 21666920 DOI: 10.1039/C1Cs15098G  1
2011 Catlow CR, Sokol AA, Walsh A. Microscopic origins of electron and hole stability in ZnO. Chemical Communications (Cambridge, England). 47: 3386-8. PMID 21327201 DOI: 10.1039/C1Cc10314H  1
2011 Chen S, Gong XG, Walsh A, Wei SH. Structural, electronic and defect properties of Cu 2ZnSn(S,Se) 4 alloys Materials Research Society Symposium Proceedings. 1370: 55-66. DOI: 10.1557/Opl.2011.764  1
2011 Zhang KHL, Regoutz A, Palgrave RG, Payne DJ, Egdell RG, Walsh A, Collins SP, Wermeille D, Cowley RA. Determination of the Poisson ratio of (001) and (111) oriented thin films of In 2O 3 by synchrotron-based x-ray diffraction Physical Review B - Condensed Matter and Materials Physics. 84. DOI: 10.1103/Physrevb.84.233301  1
2011 Zhai YT, Chen S, Yang JH, Xiang HJ, Gong XG, Walsh A, Kang J, Wei SH. Structural diversity and electronic properties of Cu2SnX 3 (X=S, Se): A first-principles investigation Physical Review B - Condensed Matter and Materials Physics. 84. DOI: 10.1103/Physrevb.84.075213  1
2011 Chen S, Gong XG, Duan CG, Zhu ZQ, Chu JH, Walsh A, Yao YG, Ma J, Wei SH. Band structure engineering of multinary chalcogenide topological insulators Physical Review B - Condensed Matter and Materials Physics. 83. DOI: 10.1103/Physrevb.83.245202  1
2011 Walsh A, Catlow CRA, Smith AGH, Sokol AA, Woodley SM. Strontium migration assisted by oxygen vacancies in SrTiO3 from classical and quantum mechanical simulations Physical Review B - Condensed Matter and Materials Physics. 83. DOI: 10.1103/Physrevb.83.220301  1
2011 Walsh A, Catlow CRA, Zhang KHL, Egdell RG. Control of the band-gap states of metal oxides by the application of epitaxial strain: The case of indium oxide Physical Review B - Condensed Matter and Materials Physics. 83. DOI: 10.1103/Physrevb.83.161202  1
2011 Chen S, Walsh A, Yang JH, Gong XG, Sun L, Yang PX, Chu JH, Wei SH. Compositional dependence of structural and electronic properties of Cu 2ZnSn(S,Se)4 alloys for thin film solar cells Physical Review B - Condensed Matter and Materials Physics. 83. DOI: 10.1103/Physrevb.83.125201  1
2011 Walsh A, Chen S, Gong XG, Wei SH. Crystal structure and defect reactions in the kesterite solar cell absorber Cu 2ZnSnS 4 (CZTS): Theoretical insights Aip Conference Proceedings. 1399: 63-64. DOI: 10.1063/1.3666258  1
2011 Payne DJ, Robinson MDM, Egdell RG, Walsh A, McNulty J, Smith KE, Piper LFJ. The nature of electron lone pairs in BiVO4 Applied Physics Letters. 98. DOI: 10.1063/1.3593012  1
2011 Walsh A, Woodley SM, Catlow CRA, Sokol AA. Potential energy landscapes for anion Frenkel-pair formation in ceria and india Solid State Ionics. 184: 52-56. DOI: 10.1016/J.Ssi.2010.08.010  1
2010 Zhang KH, Walsh A, Catlow CR, Lazarov VK, Egdell RG. Surface energies control the self-organization of oriented In2O3 nanostructures on cubic zirconia. Nano Letters. 10: 3740-6. PMID 20718401 DOI: 10.1021/Nl102403T  1
2010 Sokol AA, Catlow CR, Miskufova M, Shevlin SA, Al-Sunaidi AA, Walsh A, Woodley SM. On the problem of cluster structure diversity and the value of data mining. Physical Chemistry Chemical Physics : Pccp. 12: 8438-45. PMID 20614093 DOI: 10.1039/C0Cp00068J  1
2010 Walsh A, Woodley SM. Evolutionary structure prediction and electronic properties of indium oxide nanoclusters. Physical Chemistry Chemical Physics : Pccp. 12: 8446-53. PMID 20603669 DOI: 10.1039/C0Cp00056F  1
2010 Walsh A, Catlow CR. Photostimulated reduction processes in a titania hybrid metal-organic framework. Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry. 11: 2341-4. PMID 20593438 DOI: 10.1002/Cphc.201000306  1
2010 Catlow CR, Guo ZX, Miskufova M, Shevlin SA, Smith AG, Sokol AA, Walsh A, Wilson DJ, Woodley SM. Advances in computational studies of energy materials. Philosophical Transactions. Series a, Mathematical, Physical, and Engineering Sciences. 368: 3379-456. PMID 20566517 DOI: 10.1098/Rsta.2010.0111  1
2010 Chen S, Walsh A, Luo Y, Yang JH, Gong XG, Wei SH. Wurtzite-derived polytypes of kesterite and stannite quaternary chalcogenide semiconductors Physical Review B - Condensed Matter and Materials Physics. 82. DOI: 10.1103/Physrevb.82.195203  1
2010 Körber C, Krishnakumar V, Klein A, Panaccione G, Torelli P, Walsh A, Da Silva JLF, Wei SH, Egdell RG, Payne DJ. Electronic structure of In2 O3 and Sn-doped In 2 O3 by hard x-ray photoemission spectroscopy Physical Review B - Condensed Matter and Materials Physics. 81. DOI: 10.1103/Physrevb.81.165207  1
2010 O'Neil DH, Walsh A, Jacobs RMJ, Kuznetsov VL, Egdell RG, Edwards PP. Experimental and density-functional study of the electronic structure of In4Sn3O12 Physical Review B - Condensed Matter and Materials Physics. 81. DOI: 10.1103/Physrevb.81.085110  1
2010 Huda MN, Walsh A, Yan Y, Wei SH, Al-Jassim MM. Electronic, structural, and magnetic effects of 3d transition metals in hematite Journal of Applied Physics. 107: 123712. DOI: 10.1063/1.3432736  1
2010 Sokol AA, Walsh A, Catlow CRA. Oxygen interstitial structures in close-packed metal oxides Chemical Physics Letters. 492: 44-48. DOI: 10.1016/J.Cplett.2010.04.029  1
2009 Scanlon DO, Morgan BJ, Watson GW, Walsh A. Acceptor levels in p-type Cu(2)O: rationalizing theory and experiment. Physical Review Letters. 103: 096405. PMID 19792817 DOI: 10.1103/Physrevlett.103.096405  1
2009 Scanlon DO, Walsh A, Morgan BJ, Watson GW. Competing defect mechanisms and hydrogen adsorption on Li-doped MgO low index surfaces: A DFT+U study? E-Journal of Surface Science and Nanotechnology. 7: 395-404. DOI: 10.1380/Ejssnt.2009.395  1
2009 Huda MN, Yan Y, Walsh A, Wei SH, Al-Jassim MM. Group-IIIA versus IIIB delafossites: Electronic structure study Physical Review B. 80: 35205. DOI: 10.1103/Physrevb.80.035205  1
2009 Arnold T, Payne DJ, Bourlange A, Hu JP, Egdell RG, Piper LFJ, Colakerol L, De Masi A, Glans PA, Learmonth T, Smith KE, Guo J, Scanlon DO, Walsh A, Morgan BJ, et al. X-ray spectroscopic study of the electronic structure of CuCrO2 Physical Review B - Condensed Matter and Materials Physics. 79. DOI: 10.1103/Physrevb.79.075102  1
2009 Walsh A, Silva JLFD, Yan Y, Al-Jassim MM, Wei S. Origin of electronic and optical trends in ternary In 2 O 3 (ZnO) n transparent conducting oxides (n=1,3,5) : Hybrid density functional theory calculations Physical Review B. 79: 73105. DOI: 10.1103/Physrevb.79.073105  1
2009 Scanlon DO, Walsh A, Morgan BJ, Watson GW, Payne DJ, Egdell RG. Effect of Cr substitution on the electronic structure of CuAl 1-xCrxO2 Physical Review B - Condensed Matter and Materials Physics. 79. DOI: 10.1103/Physrevb.79.035101  1
2009 Huda MN, Yan Y, Walsh A, Wei SH, Al-Jassim MM. Symmetry-breaking-induced enhancement of visible light absorption in delafossite alloys Applied Physics Letters. 94: 251907. DOI: 10.1063/1.3157840  1
2009 Walsh A, Catlow CRA, Sokol AA, Woodley SM. Physical properties, intrinsic defects, and phase stability of indium sesquioxide Chemistry of Materials. 21: 4962-4969. DOI: 10.1021/Cm902280Z  1
2009 Scanlon DO, Walsh A, Watson GW. Understanding the p-type conduction properties of the transparent conducting oxide cuBO2: A density functional theoryanalysis Chemistry of Materials. 21: 4568-4576. DOI: 10.1021/Cm9015113  1
2009 Walsh A, Yan Y, Huda MN, Al-Jassim MM, Wei SH. Band Edge Electronic Structure of BiVO4: Elucidating the Role of the Bi s and V d Orbitals Chemistry of Materials. 21: 547-551. DOI: 10.1021/Cm802894Z  1
2008 Walsh A, Da Silva JL, Wei SH. Theoretical description of carrier mediated magnetism in cobalt doped ZnO. Physical Review Letters. 100: 256401. PMID 18643681 DOI: 10.1103/Physrevlett.100.256401  1
2008 Walsh A, Da Silva JL, Wei SH, Körber C, Klein A, Piper LF, DeMasi A, Smith KE, Panaccione G, Torelli P, Payne DJ, Bourlange A, Egdell RG. Nature of the band gap of In2O3 revealed by first-principles calculations and x-ray spectroscopy. Physical Review Letters. 100: 167402. PMID 18518246 DOI: 10.1103/Physrevlett.100.167402  1
2008 Walsh A, Silva JLFD, Wei SH. Symmetry-Induced Transparency in Conductive Metal Oxides for Optoelectronics Spie Newsroom. DOI: 10.1117/2.1200810.1368  1
2008 Godinho KG, Watson GW, Walsh A, Green AJH, Payne DJ, Harmer J, Egdell RG. A comparative study of the electronic structures of SrCu2O 2 and PbCu2O2 by density functional theory, high resolution X-ray photoemission and electron paramagnetic resonance spectroscopy Journal of Materials Chemistry. 18: 2798-2806. DOI: 10.1039/B719364E  1
2008 Walsh A, Yan Y, Al-Jassim MM, Wei S. Electronic, energetic, and chemical effects of intrinsic defects and Fe-doping of CoAl2O4: A DFT+U study Journal of Physical Chemistry C. 112: 12044-12050. DOI: 10.1021/Jp711566K  1
2008 Scanlon DO, Walsh A, Morgan BJ, Watson GW. An ab initio study of reduction of V2O5 through the formation of oxygen vacancies and Li intercalation Journal of Physical Chemistry C. 112: 9903-9911. DOI: 10.1021/Jp711334F  1
2007 Walsh A, Wei SH, Yan Y, Al-Jassim MM, Turner JA, Woodhouse M, Parkinson BA. Structural, magnetic, and electronic properties of the Co-Fe-Al oxide spinel system: Density-functional theory calculations Physical Review B - Condensed Matter and Materials Physics. 76. DOI: 10.1103/Physrevb.76.165119  1
2007 Payne DJ, Egdell RG, Paolicelli G, Offi F, Panaccione G, Lacovig P, Monaco G, Vanko G, Walsh A, Watson GW, Guo J, Beamson G, Glans PA, Learmonth T, Smith KE. Nature of electronic states at the Fermi level of metallic β-Pb O2 revealed by hard x-ray photoemission spectroscopy Physical Review B - Condensed Matter and Materials Physics. 75. DOI: 10.1103/Physrevb.75.153102  1
2007 Payne DJ, Egdell RG, Law DSL, Glans PA, Learmonth T, Smith KE, Guo J, Walsh A, Watson GW. Experimental and theoretical study of the electronic structures of α-PbO and β-PbO2 Journal of Materials Chemistry. 17: 267-277. DOI: 10.1039/B612323F  1
2007 Scanion DO, Welsh A, Morgan BJ, Nolan M, Fearon J, Watson GW. Surface sensitivity in lithium-doping of MgO: A density functional theory study with correction for on-site coulomb interactions Journal of Physical Chemistry C. 111: 7971-7979. DOI: 10.1021/Jp070200Y  0.36
2006 Payne DJ, Egdell RG, Walsh A, Watson GW, Guo J, Glans PA, Learmonth T, Smith KE. Electronic origins of structural distortions in post-transition metal oxides: experimental and theoretical evidence for a revision of the lone pair model. Physical Review Letters. 96: 157403. PMID 16712195 DOI: 10.1103/Physrevlett.96.157403  1
2006 Walsh A, Watson GW, Payne DJ, Atkinson G, Egdell RG. A theoretical and experimental study of the distorted pyrochlore Bi 2Sn2O7 Journal of Materials Chemistry. 16: 3452-3458. DOI: 10.1039/B606413B  1
2005 Walsh A, Watson GW. Influence of the anion on lone pair formation in Sn(II) monochalcogenides: a DFT study. The Journal of Physical Chemistry. B. 109: 18868-75. PMID 16853428 DOI: 10.1021/Jp051822R  1
2005 Glans PA, Learmonth T, Smith KE, Guo J, Walsh A, Watson GW, Terzi F, Egdell RG. Experimental and theoretical study of the electronic structure of HgO and Tl2O3 Physical Review B - Condensed Matter and Materials Physics. 71. DOI: 10.1103/Physrevb.71.235109  1
2005 Payne DJ, Egdell RG, Hao W, Foord JS, Walsh A, Watson GW. Why is lead dioxide metallic? Chemical Physics Letters. 411: 181-185. DOI: 10.1016/J.Cplett.2005.06.023  1
2004 Glans PA, Learmonth T, McGuinness C, Smith KE, Guo J, Walsh A, Watson GW, Egdell RG. On the involvement of the shallow core 5d level in the bonding in HgO Chemical Physics Letters. 399: 98-101. DOI: 10.1016/J.Cplett.2004.09.145  1
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