Modelling amorphous materials via a joint solid-state NMR and X-ray absorption spectroscopy and DFT approach: application to alumina Angela Harper, Steffen P. Emge, Pieter C. M. Magusin, Clare B. Grey, Andrew J. Morris
Chemical Science, Dec 2022 DOI: 10.1039/D2SC04035B Journal Paper I09-Surface and Interface Structural Analysis open access Irreversible anion oxidation leads to dynamic charge compensation in the Ru-poor, Li-rich cathode Li2Ru0.3Mn0.7O3 Joshua J. Zak, Mateusz Zuba, Zachary W. Lebens-Higgins, Heran Huang, Matthew J. Crafton, Nathan F. Dalleska, Bryan D. Mccloskey, Louis F. J. Piper, Kimberly A. See
Acs Energy Letters, Dec 2022 DOI: 10.1021/acsenergylett.2c02537 Band alignments, electronic structure, and core-level spectra of bulk molybdenum dichalcogenides (MoS2, MoSe2, and MoTe2) Leanne A. H. Jones, Zongda Xing, Jack E. N. Swallow, Huw Shiel, Thomas J. Featherstone, Matthew J. Smiles, Nicole Fleck, Pardeep K. Thakur, Tien-Lin Lee, Laurence J. Hardwick, David O. Scanlon, Anna Regoutz, Tim D. Veal, Vinod R. Dhanak
The Journal Of Physical Chemistry C, 44 Dec 2022 DOI: 10.1021/acs.jpcc.2c05100 Journal Paper I09-Surface and Interface Structural Analysis open access Effect of current density on the solid electrolyte interphase formation at the lithium∣Li6PS5Cl interface Sudarshan Narayanan, Ulderico Ulissi, Joshua S. Gibson, Yvonne A. Chart, Robert S Weatherup, Mauro Pasta
Nature Communications, 13 Nov 2022 DOI: 10.1038/s41467-022-34855-9 Journal Paper I09-Surface and Interface Structural Analysis open access Direct determination of band-gap renormalization in degenerately doped ultrawide band gap β-Ga2O3 semiconductor Jiaye Zhang, Joe Willis, Zhenni Yang, Ziqian Sheng, Lai-Sen Wang, Tien-Lin Lee, Lang Chen, David O. Scanlon, Kelvin H. L. Zhang
Physical Review B, 106 Nov 2022 DOI: 10.1103/PhysRevB.106.205305 Using polycyclic aromatic hydrocarbons for graphene growth on Cu(111) under ultra-high vacuum Benedikt P. Klein, Matthew A. Stoodley, Matthew Edmondson, Luke A. Rochford, Marc Walker, Lars Sattler, Sebastian Weber, Gerhard Hilt, Leon B. S. Williams, Tien-Lin Lee, Alex Saywell, Reinhard J. Maurer, David A. Duncan
Applied Physics Letters, 121 Nov 2022 DOI: 10.1063/5.0122914 Journal Paper I09-Surface and Interface Structural Analysis open access On the use of Ti3C2Tx MXene as a negative electrode material for lithium-ion batteries Tatiana Koriukina, Antonia Kotronia, Joseph Halim, Maria Hahlin, Johanna Rosen, Kristina Edström, Leif Nyholm
Acs Omega, Nov 2022 DOI: 10.1021/acsomega.2c05785 Journal Paper I09-Surface and Interface Structural Analysis open access Computational prediction and experimental realization of earth-abundant transparent conducting oxide Ga-doped ZnSb2O6 Adam J. Jackson, Benjamin J. Parrett, Joe Willis, Alex M. Ganose, W. W. Winnie Leung, Yuhan Liu, Benjamin A. D. Williamson, Timur K. Kim, Moritz Hoesch, Larissa S. I. Veiga, Raman Kalra, Jens Neu, Charles A. Schmuttenmaer, Tien-Lin Lee, Anna Regoutz, Tung-Chun Lee, Tim D. Veal, Robert G. Palgrave, Robin Perry, David O. Scanlon
Acs Energy Letters, Oct 2022 DOI: 10.1021/acsenergylett.2c01961 Journal Paper I09-Surface and Interface Structural Analysis open access Atomic layer grown zinc–tin oxide as an alternative buffer layer for Cu2ZnSnS4-based thin film solar cells: influence of absorber surface treatment on buffer layer growth Natalia M. Martin, Tobias Torndahl, Melike Babucci, Fredrik Larsson, Konstantin Simonov, Dorotea Gajdek, Lindsay R. Merte, Hakan Rensmo, Charlotte Platzer-Bjorkman
Acs Applied Energy Materials, Oct 2022 DOI: 10.1021/acsaem.2c02579 Journal Paper I09-Surface and Interface Structural Analysis open access N-heterocyclic carbenes: molecular porters of surface mounted Ru-porphyrins Peter Knecht, Dennis Meier, Joachim Reichert, David A. Duncan, Martin Schwarz, Johannes Kuchle, Tien-Lin Lee, Peter Deimel, Peter Feulner, Francesco Allegretti, Willi Auwärter, Guillaume Médard, Ari P. Seitsonen, Johannes V. Barth, Anthoula Papageorgiou
Angewandte Chemie International Edition, Oct 2022 DOI: 10.1002/anie.202211877 Journal Paper I09-Surface and Interface Structural Analysis open access Vertical structure of Sb-intercalated quasifreestanding graphene on SiC(0001) You-Ron Lin, Susanne Wolff, Philip Schädlich, Mark Hutter, Serguei Soubatch, Tien-Lin Lee, F. Stefan Tautz, Thomas Seyller, Christian Kumpf, Francois Bocquet
Physical Review B, 106 Oct 2022 DOI: 10.1103/PhysRevB.106.155418 P-type conductivity in Sn-doped Sb2Se3 Theodore D. C. Hobson, Huw Shiel, Christopher N. Savory, Jack E. N. Swallow, Leanne A. H. Jones, Thomas J. Featherstone, Matthew J. Smiles, Pardeep K. Thakur, Tien-Lin Lee, Bhaskar Das, Chris Leighton, Guillaume Zoppi, Vin R. Dhanak, David O. Scanlon, Tim D. Veal, Ken Durose, Jonathan D. Major
Journal Of Physics: Energy, Sept 2022 DOI: 10.1088/2515-7655/ac91a6 Journal Paper I09-Surface and Interface Structural Analysis open access Indium epitaxy on SiC(0001): a roadmap to large scale growth of the quantum spin hall insulator indenene Jonas Erhardt, Maximilian Bauernfeind, Philipp Eck, Martin Kamp, Judith Gabel, Tien-Lin Lee, Giorgio Sangiovanni, Simon Moser, Ralph Claessen
The Journal Of Physical Chemistry C, 260 Sept 2022 DOI: 10.1021/acs.jpcc.2c05809 Complex magnetic order in topochemically reduced Rh(I)/Rh(III) LaM0.5Rh0.5O2.25 (M = Co, Ni) phases Zheying Xu, Pardeep K. Thakur, Tien-Lin Lee, Anna Regoutz, Emmanuelle Suard, Inés Puente-Orench, Michael A. Hayward
Inorganic Chemistry, 2 Sept 2022 DOI: 10.1021/acs.inorgchem.2c02747 Journal Paper I09-Surface and Interface Structural Analysis I11-High Resolution Powder Diffraction open access Vertically aligned Ni/NiO nanocomposites with abundant oxygen deficient hetero-interfaces for enhanced overall water splitting Hongxia Wang, Meiyan Cui, Gaoliang Fu, Jiaye Zhang, Xingyu Ding, Irene Azaceta, Matthew Bugnet, Demie M. Kepaptsoglou, Vlado K. Lazarov, Víctor A. De La Pena O'Shea, Freddy E. Oropeza, Kelvin H. L. Zhang
Science China Chemistry, 16 Sept 2022 DOI: 10.1007/s11426-022-1326-2 Charge transfer and built-in fields at a semiconductor-crystalline oxide interface: effects of the interface dipole and surface termination Matthew Dennis Chrysler
Aug 2022 Thesis I09-Surface and Interface Structural Analysis
Machine learning at the nanoscale Oliver M. Gordon
Aug 2022 Thesis I09-Surface and Interface Structural Analysis
Silicene's pervasive surface alloy on Ag(111): a scaffold for two-dimensional growth Johannes T. Küchle, Aleksandr Baklanov, Ari Paavo Seitsonen, Paul Ryan, Peter Feulner, Prashanth Pendem, Tien-Lin Lee, Matthias Muntwiler, Martin Schwarz, Felix Haag, Johannes V Barth, Willi Auwärter, David A. Duncan, Francesco Allegretti
2d Materials, Aug 2022 DOI: 10.1088/2053-1583/ac8a01 Journal Paper I09-Surface and Interface Structural Analysis open access Tackling disorder in γ‐Ga2O3 Laura E. Ratcliff, Takayoshi Oshima, Felix Nippert, Benjamin M. Janzen, Elias Kluth, Rüdiger Goldhahn, Martin Feneberg, Piero Mazzolini, Oliver Bierwagen, Charlotte Wouters, Musbah Nofal, Martin Albrecht, Jack E. N. Swallow, Leanne A. H. Jones, Pardeep K. Thakur, Tien-Lin Lee, Curran Kalha, Christoph Schlueter, Tim D. Veal, Joel B. Varley, Markus R. Wagner, Anna Regoutz
Advanced Materials, Jul 2022 DOI: 10.1002/adma.202204217 Journal Paper I09-Surface and Interface Structural Analysis open access Resistive switching in Pr1−xCaxMnO3/YSZ conclusive model and switching kinetics Benedikt Johannes Arndt
Jul 2022 Thesis I09-Surface and Interface Structural Analysis
Insights into post-growth doping and proposals for CdTe:In photovoltaic devices Luke Thomas, Theo D. C. Hobson, Laurie J. Phillips, Kieran J. Cheetham, Neil Tarbuck, Leanne A. H. Jones, Matthew J. Smiles, Chris H. Don, Pardeep K. Thakur, Mark Isaacs, Huw Shiel, Stephen Campbell, Vincent Barrioz, Vin Dhanak, Tim Veal, Jonathan D. Major, Ken Durose
Journal Of Physics: Energy, June 2022 DOI: 10.1088/2515-7655/ac7ad5 Journal Paper I09-Surface and Interface Structural Analysis open access Spontaneous lithiation of binary oxides during epitaxial growth on LiCoO2 Le Wang, Zhenzhong Yang, Widitha S. Samarakoon, Yadong Zhou, Mark E. Bowden, Hua Zhou, Jinhui Tao, Zihua Zhu, Nabajit Lahiri, Timothy C. Droubay, Zachary W. Lebens-Higgins, Xinmao Yin, Chi Sin Tang, Zhenxing Feng, Louis F. J. Piper, Andrew T. S. Wee, Scott A. Chambers, Yingge Du
Nano Letters, 9 June 2022 DOI: 10.1021/acs.nanolett.2c01701 Epitaxial SrTiO3 films with dielectric constants exceeding 25,000 Zhifei Yang, Dooyong Lee, Jin Yue, Judith Gabel, Tien-Lin Lee, Richard D. James, Scott A. Chambers, Bharat Jalan
Proceedings Of The National Academy Of Sciences, 119 June 2022 DOI: 10.1073/pnas.2202189119 Journal Paper I09-Surface and Interface Structural Analysis open access Boron nitride on SiC(0001) You-Ron Lin, Markus Franke, Shayan Parhizkar, Miriam Raths, Victor Wen-Zhe Yu, Tien-Lin Lee, Serguei Soubatch, Volker Blum, F. Stefan Tautz, Christian Kumpf, Francois C. Bocquet
Physical Review Materials, 6 June 2022 DOI: 10.1103/PhysRevMaterials.6.064002 Atomic-site-specific surface valence-band structure from X-ray standing-wave excited photoemission Yanna Chen, Leighton O. Jones, Tien-Lin Lee, Anusheela Das, Martín A. Mosquera, Denis T. Keane, George C. Schatz, Michael J. Bedzyk
Physical Review Letters, 128 May 2022 DOI: 10.1103/PhysRevLett.128.206801 Selective hydrogenation of graphene on Ir(111): an X-ray standing wave study Claus F. P. Kastorp, David A. Duncan, Anders l. Jørgensen, Martha Scheffler, John D. Thrower, Tien-Lin Lee, Liv Hornekaer, Richard Balog
Faraday Discussions, 141 May 2022 DOI: 10.1039/D1FD00122A Journal Paper I09-Surface and Interface Structural Analysis open access Order, disorder, and metalation of tetraphenylporphyrin (2H-TPP) on Au(111) Matthew Edmondson, Eleanor S. Frampton, Chris J. Judd, Neil R. Champness, Robert G. Jones, Alex Saywell
Chemical Communications, 58 May 2022 DOI: 10.1039/D2CC00820C Journal Paper I09-Surface and Interface Structural Analysis open access GeSe photovoltaics: doping, interfacial layer and devices Matthew J. Smiles, Thomas Shalvey, Luke Thomas, Theodore D. C. Hobson, Leanne A. H. Jones, Laurie Phillips, Christopher Don, Thomas Beesley, Pardeep K. Thakur, Tien-Lin Lee, Ken Durose, Jonathan D. Major, Tim Veal
Faraday Discussions, Apr 2022 DOI: 10.1039/D2FD00048B Journal Paper I09-Surface and Interface Structural Analysis open access Direct experimental evidence for substrate adatom incorporation into a molecular overlayer Philip J. Mousley, Luke A. Rochford, Paul T. P. Ryan, Philip Blowey, James Lawrence, David A. Duncan, Hadeel Hussain, Billal Sohail, Tien-Lin Lee, Gavin R. Bell, Giovanni Costantini, Reinhard J. Maurer, Christopher Nicklin, D. Phil Woodruff
The Journal Of Physical Chemistry C, Apr 2022 DOI: 10.1021/acs.jpcc.2c01432 Journal Paper I07-Surface & interface diffraction I09-Surface and Interface Structural Analysis open access Evaluation of the thermal stability of TiW/Cu heterojunctions using a combined SXPS and HAXPES approach C. Kalha, M. Reisinger, P. K. Thakur, T.-L. Lee, S. Venkatesan, M. Isaacs, R. G. Palgrave, J. Zechner, M. Nelhiebel, A. Regoutz
Journal Of Applied Physics, 131 Apr 2022 DOI: 10.1063/5.0086009 Journal Paper I09-Surface and Interface Structural Analysis open access Thermodynamic driving forces for substrate atom extraction by adsorption of strong electron acceptor molecules Paul Ryan, Philip James Blowey, Billal S. Sohail, Luke A. Rochford, David A. Duncan, Tien-Lin Lee, Peter Starrs, Giovanni Costantini, Reinhard J. Maurer, David Phillip Woodruff
The Journal Of Physical Chemistry C, Mar 2022 DOI: 10.1021/acs.jpcc.2c00711 Journal Paper I09-Surface and Interface Structural Analysis open access Deep UV transparent conductive oxide thin films realized through degenerately doped wide-bandgap gallium oxide Jiaye Zhang, Joe Willis, Zhenni Yang, Xu Lian, Wei Chen, Lai-Sen Wang, Xiangyu Xu, Tien-Lin Lee, Lang Chen, David O. Scanlon, Kelvin H. I. Zhang
Cell Reports Physical Science, 6 Mar 2022 DOI: 10.1016/j.xcrp.2022.100801 Journal Paper I09-Surface and Interface Structural Analysis open access Cycle-induced interfacial degradation and transition-metal cross-over in LiNi0.8Mn0.1Co0.1O2–graphite cells Erik Bjorklund, Chao Xu, Wesley M. Dose, Christopher G. Sole, Pardeep K. Thakur, Tien-Lin Lee, Michael F. L. De Volder, Clare P. Grey, Robert S. Weatherup
Chemistry Of Materials, Feb 2022 DOI: 10.1021/acs.chemmater.1c02722 Journal Paper I09-Surface and Interface Structural Analysis open access Lifetime effects and satellites in the photoelectron spectrum of tungsten metal C. Kalha, L. E. Ratcliff, J. J. Gutiérrez Moreno, S. Mohr, M. Mantsinen, N. K. Fernando, P. K. Thakur, T.-L. Lee, H.-H. Tseng, T. S. Nunney, J. M. Kahk, J. Lischner, A. Regoutz
Physical Review B, 105 Jan 2022 DOI: 10.1103/PhysRevB.105.045129 Evidence of magnetism-induced topological protection in the axion insulator candidate EuSn2P2 Gian Marco Pierantozzi, Alessandro De Vita, Chiara Bigi, Xin Gui, Hung-Ju Tien, Debashis Mondal, Federico Mazzola, Jun Fujii, Ivana Vobornik, Giovanni Vinai, Alessandro Sala, Cristina Africh, Tien-Lin Lee, Giorgio Rossi, Tay-Rong Chang, Weiwei Xie, Robert J. Cava, Giancarlo Panaccione
Proceedings Of The National Academy Of Sciences, 119 Jan 2022 DOI: 10.1073/pnas.2116575119 Journal Paper I09-Surface and Interface Structural Analysis open access Spatial variation of geometry, binding, and electronic properties in the moiré superstructure of MoS 2 on Au(111) Caio Silva, Daniela Dombrowski, Nicolae Atodiresei, Wouter Jolie, Ferdinand Farwick Zum Hagen, Jiaqi Cai, Paul Ryan, Pardeep Kumar Thakur, Vasile Caciuc, Stefan Bluegel, David Andrew Duncan, Thomas Michely, Tien-Lin Lee, Carsten Busse
2d Materials, Jan 2022 DOI: 10.1088/2053-1583/ac4958 Journal Paper I09-Surface and Interface Structural Analysis open access Mapping hidden space-charge distributions across crystalline metal oxide/group IV semiconductor interfaces S. A. Chambers, M. Chrysler, J. H. Ngai, T.-L. Lee, J. Gabel, B. E. Matthews, S. R. Spurgeon, M. E. Bowden, Z. Zhu, P. V. Sushko
Physical Review Materials, 6 Jan 2022 DOI: 10.1103/PhysRevMaterials.6.015002 Gently does it!: in situ preparation of alkali metal - solid electrolyte interfaces for photoelectron spectroscopy Joshua Gibson, Sudarshan Narayanan, Jack E. N. Swallow, Pardeep K. Thakur, Mauro Pasta, Tien-Lin Lee, Robert S. Weatherup
Faraday Discussions, Jan 2022 DOI: 10.1039/D1FD00118C Journal Paper I09-Surface and Interface Structural Analysis open access Correlation-induced emergent charge order in metallic vanadium dioxide Christopher N. Singh, Louis F. J. Piper, Hanjong Paik, Darrell G. Schlom, Wei-Cheng Lee
Physical Review B, 105 Jan 2022 DOI: 10.1103/PhysRevB.105.035150 Modulation of the Bi3+ 6S2 lone pair state in perovskites for high-mobility p-type oxide semiconductors Jueli Shi, Ethan A. Rubinstein, Weiwei Li, Jiaye Zhang, Ye Yang, Tien-Lin Lee, Changdong Qin, Pengfei Yan, Judith L. Macmanus-Driscoll, David O. Scanlon, Kelvin H.l. Zhang
Advanced Science, Jan 2022 DOI: 10.1002/advs.202104141 Journal Paper I09-Surface and Interface Structural Analysis open access