Layer-by-layer epitaxial growth of perovskite heterostructures with tunable band offsets Yang Lu, Young-Kwang Jung, Milos Dubajic, Xinjuan Li, Shabnum Maqbool, Qichun Gu, Xinyu Bai, Yorrick Boeije, Xian Wei Chua, Alessandro J. Mirabelli, Taeheon Kang, Lars Sonneveld, Youcheng Zhang, Thomas A. Selby, Capucine Mamak, Kan Tang, Zhongzheng Yu, Tianjun Liu, Miguel Anaya, Stephen Barlow, Seth R. Marder, Bruno Ehrler, Caterina Ducati, Richard H. Friend, Samuel D. Stranks
Science, 390 Nov 2025 DOI: 10.1126/science.adx5685 Journal Paper I07-Surface & interface diffraction I15-Extreme Conditions I19-Small Molecule Single Crystal Diffraction Switching on photoreactivity in Ti4-oxo clusters by increasing the size of 1,n-alkane diolate bridging ligands Ashwani Chikara, Alexander R. Veale, Stephen E. Brown, Jack M. Woolley, Frank De Proft, Sebastian D. Pike
Chemical Science, Nov 2025 DOI: 10.1039/D5SC08522E Journal Paper I19-Small Molecule Single Crystal Diffraction open access Structural interconversions and guest binding properties of tetrakis(formylpyridine)-based pseudo-cubic and trigonal-prismatic metal-organic capsules Jonathan R. Nitschke, Yuyin Du, Tanya K. Ronson, Yuchong Yang
Journal Of The American Chemical Society, Nov 2025 DOI: 10.1021/jacs.5c16191 Journal Paper I19-Small Molecule Single Crystal Diffraction open access A flexible copper MOF as a carboxylate-specific crystalline sponge for structure solution using X-ray and electron diffraction Russell Main, Daniel N. Rainer, Marta Bauzá, Romy Ettlinger, Nicole Kelly, Simon Coles, Sharon E. Ashbrook, Russell E. Morris
Chemical Science, Nov 2025 DOI: 10.1039/D5SC05651A Journal Paper I19-Small Molecule Single Crystal Diffraction open access The influence of metal cations on the formation of phthalocyanine/porphyrin heterodimers and nanoporous cocrystals Shannah Kerrigan, Nikolaos-Angelos Stamos, Alexander Stiven, Emma Johnson, Benjamin Plevey, Catherine Newman, Gary S. Nichol, Neil B. Mckeown
Journal Of Porphyrins And Phthalocyanines, Nov 2025 DOI: 10.1142/S1088424625501111 Tailoring a lead-free organic-inorganic halobismuthate for large piezoelectric effect Esther Y. H. Hung, Benjamin M. Gallant, Robert Harniman, Jakob Moebs, Santanu Saha, Khaled Kaja, Charles Godfrey, Shrestha Banerjee, Nikolaos Famakidis, Harish Bhaskaran, Marina R. Filip, Paolo Radaelli, Nakita K. Noel, Dominik J. Kubicki, Harry C. Sansom, Henry J. Snaith
Journal Of The American Chemical Society, Nov 2025 DOI: 10.1021/jacs.5c15484 Journal Paper I19-Small Molecule Single Crystal Diffraction open access Perylenediimide-based metal-organic frameworks: structural, electrochemical and spectroelectrochemical characterisation Joseph O. Ogar, E. Stephen Davies, Asia Almuhana, Sarah L. Griffin, Matthew A. Addicoat, Stephen P. Argent, Neil R. Champness
Dalton Transactions, Oct 2025 DOI: 10.1039/D5DT02244D Journal Paper I19-Small Molecule Single Crystal Diffraction open access Efficient capture and separation of xenon/krypton from off-gas by a radiation-resistant metal-organic framework Thien D. Duong, Jiangnan Li, Ruohan Li, Xin Lian, Yinlin Chen, Jiarui Fan, Joseph Hurd, Lixia Guo, Daniel Lee, Mark Warren, Sihai Yang
Small, 2013 Oct 2025 DOI: 10.1002/smll.202508918 Design and structural transformations of zinc(II) knotted cage frameworks Yuchong Yang, Sabrina Y. Hu, Tanya K. Ronson, Paula C. P. Teeuwen, Sudhakar Gaikwad, Andrew W. Heard, David J. Wales, Jonathan R. Nitschke
Angewandte Chemie International Edition, 109 Oct 2025 DOI: 10.1002/anie.202519491 Journal Paper I19-Small Molecule Single Crystal Diffraction open access Pressure-induced phase behaviour and compressibility of the racemic and chiral solid forms, ofloxacin and levofloxacin Julia Gasol-Cardona, Martin R. Ward, Davide Comboni, Micheal Hanfland, Rebecca Scatena, Mark R. Warren, Andrew G. P. Maloney, Iain D. H. Oswald
Crystengcomm, Oct 2025 DOI: 10.1039/D5CE00855G Journal Paper I19-Small Molecule Single Crystal Diffraction open access Selective CO2 uptake mimics dissolution in highly fluorinated non-porous crystalline materials Inigo J. Vitórica-Yrezábal, Craig A. Mcanally, Matthew P. Snelgrove, Mark R. Warren, Adrian H. Hill, Stephen P. Thompson, Martin Quinn, Sam Mottley, Stephen Mottley, Ashleigh J. Fletcher, Lee Brammer
Nature Chemistry, 532 Oct 2025 DOI: 10.1038/s41557-025-01943-4 Journal Paper I11-High Resolution Powder Diffraction I19-Small Molecule Single Crystal Diffraction open access Synchrotrons, neutron sources, and XFELs guiding the future of safe and sustainable nanomaterials Swaroop Chakraborty, Sylvia Britto, Miguel Gomez-Gonzalez, Ana Guilherme Buzanich, Iuliia Mikulska
Cell Reports Physical Science, 8 Sept 2025 DOI: 10.1016/j.xcrp.2025.102806 Journal Paper B18-Core EXAFS I14-Hard X-ray Nanoprobe I18-Microfocus Spectroscopy I19-Small Molecule Single Crystal Diffraction open access Modulator driven formation of a very complex self-catenated zinc metal-organic framework Alan Braschinsky, Davide M. Proserpio, Toby J. Blundell, Eduardo Rezende Triboni, Jonathan W. Steed
Crystal Growth & Design, Sept 2025 DOI: 10.1021/acs.cgd.5c00992 Journal Paper I19-Small Molecule Single Crystal Diffraction open access Reversible single crystal photochemistry and spin state switching in a metal-cyanide complex Michal Magott, Miroslaw Arczynski, Leszek Malec, Michał Rams, Mathieu Rouzières, Andrei Rogalev, Fabrice Wilhelm, Itziar Oyarzabal, Thomas Lohmiller, Alexander Schnegg, Coen De Graaf, Corine Mathonière, Rodolphe Clérac, Dawid Pinkowicz
Nature Communications, 16 Sept 2025 DOI: 10.1038/s41467-025-63523-x Journal Paper I19-Small Molecule Single Crystal Diffraction open access Supramolecular support of cuprophilic network bonding in 2-D copper n-alkanethiolates Maggie C. Willson, Daniel W. Paley, Elyse A. Schriber, Daniel J. Rosenberg, Daniel M. Tchon, Patience A. Kotei, Komal Rani, Cynthia Melendrez, Matthias Zeller, Tarun Kaushik, Qiaoling Fan, Chamathka Dehiwala Liyanage, Jungmin Kang, Ichiro Inoue, Kensuke Tono, Yuichi Inubushi, Aaron S. Brewster, J. Nathan Hohman
Inorganic Chemistry, Aug 2025 DOI: 10.1021/acs.inorgchem.5c02024 Arene activation by calcium hydride/zinc amide equilibration Kyle G. Pearce, Agustín Morales, Michael S. Hill, Mary F. Mahon, Claire L. Mcmullin
Journal Of The American Chemical Society, Aug 2025 DOI: 10.1021/jacs.5c10735 Journal Paper I19-Small Molecule Single Crystal Diffraction open access Fluorinated twists: a pathway to a stable Pd8L16 square antiprism Soumalya Bhattacharyya, Stephen P. Argent, Ben S. Pilgrim
Journal Of The American Chemical Society, Aug 2025 DOI: 10.1021/jacs.5c09573 Journal Paper I19-Small Molecule Single Crystal Diffraction open access In situ single-crystal X-ray diffraction studies of an anomalous nitric oxide adsorption in a partially activated metal-organic framework Russell M. Main, Romy Ettlinger, Tia K. Tajnšek, Deborah A. Brako-Amoafo, Maximillian G. Stanzione, Morven J. Duncan, Philip Ettlinger, Gaynor B. Lawrence, Mark R. Warren, Christopher J. Heard, Russell E. Morris
Journal Of The American Chemical Society, Aug 2025 DOI: 10.1021/jacs.5c10395 Journal Paper I19-Small Molecule Single Crystal Diffraction open access A dynamic silver(I) nanocluster holds together a 3 × 3 self-assembled grid Andrew W. Heard, Luca Pesce, Peter T. Gierth, Simone Adorinni, Tanya K. Ronson, Barbara Rossi, John D. Thoburn, Tomas Deingruber, Martin Welch, David R. Spring, Silvia Marchesan, Giovanni M. Pavan, Jonathan R. Nitschke
Journal Of The American Chemical Society, Aug 2025 DOI: 10.1021/jacs.5c07271 Journal Paper I19-Small Molecule Single Crystal Diffraction open access Steric and geometric tuning of π-conjugated antennae in europium(III) complexes for selective ADP recognition Samantha E. Bodman, Stephen J. Butler
Chemistry – A European Journal, 42 Aug 2025 DOI: 10.1002/chem.202502251 Journal Paper I19-Small Molecule Single Crystal Diffraction open access Crystallizing the uncrystallizable: insights from extensive screening of PROTACs Martin A. Screen, James F. Mccabe, Sean Askin, Jamie L. Guest, Paul Hodgkinson, Aurora J. Cruz-Cabeza, Toby J. Blundell, Daniel N. Rainer, Simon J. Coles, Alexandra Longcake, Michael R. Probert, Clare S. Mahon, Mark R. Wilson, Jonathan W. Steed
Journal Of The American Chemical Society, 95 Jul 2025 DOI: 10.1021/jacs.5c07977 Journal Paper I19-Small Molecule Single Crystal Diffraction open access The varying temperature- and pressure-induced phase transition pathways in hybrid improper ferroelectric Sr3Sn2O7 Evie Ladbrook, Jeremiah P. Tidey, Fei-Ting Huang, Sang-Wook Cheong, Dominik Daisenberger, Mark R. Warren, Mark S. Senn
Acta Crystallographica Section B Structural Science, Crystal Engineering And Materials, 81 June 2025 DOI: 10.1107/S2052520625002306 Journal Paper I19-Small Molecule Single Crystal Diffraction open access Segmented milli-fluidic crystallisation of paracetamol with in situ single-crystal X-ray diffraction Karen Robertson, Mark R. Warren, Lois E. Wayment, Pollyanna Payne, C. Daniel Scott, Chick C. Wilson, Lucy K. Saunders, Graeme Winter, Benjamin Williams, Lauren E. Hatcher, David R. Allan
Chemical Science, June 2025 DOI: 10.1039/D4SC08565E Journal Paper I19-Small Molecule Single Crystal Diffraction open access Dynamic nanodomains dictate macroscopic properties in lead halide perovskites Milos Dubajic, James R. Neilson, Johan Klarbring, Xia Liang, Stephanie A. Bird, Kirrily C. Rule, Josie E. Auckett, Thomas A. Selby, Ganbaatar Tumen-Ulzii, Yang Lu, Young-Kwang Jung, Cullen Chosy, Zimu Wei, Yorrick Boeije, Martin V. Zimmermann, Andreas Pusch, Leilei Gu, Xuguang Jia, Qiyuan Wu, Julia C. Trowbridge, Eve M. Mozur, Arianna Minelli, Nikolaj Roth, Kieran W. P. Orr, Arman Mahboubi Soufiani, Simon Kahmann, Irina Kabakova, Jianning Ding, Tom Wu, Gavin J. Conibeer, Stephen P. Bremner, Michael P. Nielsen, Aron Walsh, Samuel D. Stranks
Nature Nanotechnology, 10 June 2025 DOI: 10.1038/s41565-025-01917-0 Journal Paper I19-Small Molecule Single Crystal Diffraction open access Synthesis of covalently linked knotted cage frameworks Yuchong Yang, Tanya K. Ronson, Paula C. P. Teeuwen, Simone Zucchelli, Andrew W. Heard, Paola Posocco, David J. Wales, Jonathan R. Nitschke
Nature Synthesis, 115 June 2025 DOI: 10.1038/s44160-025-00822-7 Journal Paper I19-Small Molecule Single Crystal Diffraction open access Metal-free active template synthesis of catenanes Jiankang Zhong, Enzo Olivieri, Patrick Zwick, Axel Troncossi, Andrei S. Baluna, Daniel J. Tetlow, George F. S. Whitehead, Avantika Hasija, David A. Leigh
Angewandte Chemie Novit, 1 June 2025 DOI: 10.1002/anov.70004 Journal Paper I19-Small Molecule Single Crystal Diffraction open access Pressure-induced enhancement of polar distortions in a metal and implications for the Rashba spin splitting Evie Ladbrook, Urmimala Dey, Nicholas C. Bristowe, Robin S. Perry, Dominik Daisenberger, Mark R. Warren, Mark S. Senn
Physical Review B, 111 May 2025 DOI: 10.1103/PhysRevB.111.205110 Fluoride enhances alcohol binding within a trigonal-prismatic metal-organic capsule Yuchong Yang, Tanya K. Ronson, Dingyu Hou, Kai H. Luo, Jonathan R. Nitschke
Angewandte Chemie International Edition, May 2025 DOI: 10.1002/anie.202505137 Journal Paper I19-Small Molecule Single Crystal Diffraction open access Core-twisted, cationic perylene diimides; homochiral dimerization and chiroptical anion sensing Denis Hartmann, Jamie S. Hillis, Lucy E. Walker, Timothy A. Barendt
Chemistry – A European Journal, May 2025 DOI: 10.1002/chem.202501270 Journal Paper I19-Small Molecule Single Crystal Diffraction open access Pseudo [M(II)7] (M = Co, Ni and Zn) metallocalix[6]arene hosts encapsulate a range of organic guest molecules in the solid state Leigh F. Jones, Mari E. Slater-Parry, David Townrow, Rebecca Ellaby, Samuel J. Page, Chotima Ratanasakprakan, Sean T. Meally
Crystengcomm, May 2025 DOI: 10.1039/D5CE00341E Photoabsorption of 1–2 nm molecular Ce-oxo nanoclusters versus ceria: intervalence charge transfer but no size effects Stephen E. Brown, Sebastian Pike
Chemical Science, 116 May 2025 DOI: 10.1039/D5SC00905G Journal Paper I11-High Resolution Powder Diffraction I19-Small Molecule Single Crystal Diffraction open access The application of acoustics for sample manipulation and delivery at X-Ray Light Sources Peter Docker, Danny Axford, Mark R. Warren, Beth Galtry, Mark Frogley, Gianfelice Cinque, Gabriel Leen, Nikolay Pavlov, Romain Bordes
Journal Of Physics: Conference Series, 3010 May 2025 DOI: 10.1088/1742-6596/3010/1/012146 Conference Paper B22-Multimode InfraRed imaging And Microspectroscopy I19-Small Molecule Single Crystal Diffraction open access Electron-density analysis of halide...halide through-space magnetic exchange Rebecca Scatena, Zachary E. Manson, Jamie L. Manson, David R. Allan, Paul A. Goddard, Roger D. Johnson
Journal Of Applied Crystallography, 58 Apr 2025 DOI: 10.1107/S1600576725000536 The impact of whole-molecule disorder on spin-crossover in a family of isomorphous molecular crystals Holly E. Sephton, Rhiannon L. Watson, Namrah Shahid, Hari Babu Vasili, Daniel Baker, Dipankar Saha, Izar Capel Berdiell, Christopher M. Pask, Oscar Cespedes, Malcolm Halcrow
Chemical Science, Apr 2025 DOI: 10.1039/D5SC00090D Journal Paper I19-Small Molecule Single Crystal Diffraction open access Superstructure formation through coupled anion and cation ordering in Cu-substituted lead oxyapatites Jan P. Scheifers, Adam J. D. Richardson, Hai Lin, Hongjun Niu, Luke M. Daniels, Michael W. Gaultois, Jonathan Alaria, Craig Robertson, John B. Claridge, Matthew J. Rosseinsky
Chemistry Of Materials, 45 Apr 2025 DOI: 10.1021/acs.chemmater.4c03130 Journal Paper I11-High Resolution Powder Diffraction I19-Small Molecule Single Crystal Diffraction open access Robotic exploration of amino-acid functionalised Molybdenum Blue polyoxometalate nanoclusters Haiyang Guo, Donglin He, Deliang Long, Lee Cronin
Chemical Communications, Apr 2025 DOI: 10.1039/D5CC00703H Journal Paper I19-Small Molecule Single Crystal Diffraction open access Decoupled MOF breathing: pressure-induced reversal of correlation between orthogonal motions in a diamondoid framework Lee Brammer, David Ashworth, Elliot J. Carrington, Thomas M. Roseveare, Charles J. Mcmonagle, Martin R. Ward, Ashleigh J. Fletcher, Tina Düren, Mark R. Warren, Stephen A. Moggach, Iain D. H. Oswald
Angewandte Chemie International Edition, Apr 2025 DOI: 10.1002/anie.202504297 Journal Paper I19-Small Molecule Single Crystal Diffraction open access Proton-driven lithium separation using alkali-templated coordination cages Xiang Sun, Kai Wu, Paula C. P. Teeuwen, Philipp Pracht, David J. Wales, Jonathan R. Nitschke
Chem, 141 Apr 2025 DOI: 10.1016/j.chempr.2025.102556 Journal Paper I19-Small Molecule Single Crystal Diffraction open access Two (AgI3I)4L4 cages elucidate the rules for silver-cluster vertex design Andrew W. Heard, Samuel E. Clark, Charlie T. Mcternan, Tanya K. Ronson, Petr Rozhin, Barbara Rossi, Silvia Marchesan, Jonathan R. Nitschke
Chem, 51 Mar 2025 DOI: 10.1016/j.chempr.2025.102456 Journal Paper I19-Small Molecule Single Crystal Diffraction open access A multi-resonant thermally activated delayed fluorescence emitter with a twisted second-generation carbazole dendron showing suppressed concentration quenching and its use in solution-processed organic light-emitting diodes Jingxiang Wang, Yuka Yasuda, Yongxia Ren, Ryo Kondon, David B. Cordes, Hironori Kaji, Eli Zysman-Colman
Organic Chemistry Frontiers, Mar 2025 DOI: 10.1039/D5QO00146C Journal Paper I19-Small Molecule Single Crystal Diffraction open access Solvatomorphism of a 2,6-pyridyldicarboxamide-based foldamer Sena Ozturk, Alexander R. Davis, Colin C. Seaton, Louise Male, Sarah J. Pike
Organic & Biomolecular Chemistry, 38 Mar 2025 DOI: 10.1039/D5OB00342C Journal Paper I19-Small Molecule Single Crystal Diffraction open access Synthesis and crystal structure of a nickel(II) 2′-deoxy-6-thioguanosine nitrate complex Samira O. Hribesh, William Clegg, Ross W. Harrington, Andrew Houlton, Andrew R. Pike
Acta Crystallographica Section C Structural Chemistry, 81 Mar 2025 DOI: 10.1107/S2053229625001500 Compression of molybdenum blue polyoxometalate cluster rings Vishal Lakhanpal, Melanie Guillén-Soler, Laia Vilà-Nadal, De-Liang Long, Leroy Cronin
Journal Of The American Chemical Society, Mar 2025 DOI: 10.1021/jacs.5c00187 Journal Paper I19-Small Molecule Single Crystal Diffraction open access Hydrogen bonded organic frameworks based on TTF-derivates for tunable applications Maria Vicent Morales
Mar 2025 Thesis I19-Small Molecule Single Crystal Diffraction
Total synthesis of brevianamide S Adam R. Lockyer, Helen E. Jones, Nicholas J. Green, Robert C. Godfrey, Vera P. Demertzidou, Gary S. Nichol, Andrew L. Lawrence
Organic Letters, Mar 2025 DOI: 10.1021/acs.orglett.5c00860 Journal Paper I19-Small Molecule Single Crystal Diffraction open access Flow-Diffraction: towards kinetic information from single crystals for catalysis and selective adsorption applications Anna Marini
Mar 2025 DOI: 10.5258/SOTON/D3430 Thesis I19-Small Molecule Single Crystal Diffraction Solid electrolytes: a breakthrough for safer, high-performance batteries Diamond Light Source
Jan 2025 Science Highlight I11-High Resolution Powder Diffraction I19-Small Molecule Single Crystal Diffraction
Encapsulation of hydrophobic pollutants within a large water-soluble [Fe4L6]4− cage Jack D. Wright, George F. S. Whitehead, Edward O. Pyzer-Knapp, Imogen A. Riddell
Cell Reports Physical Science, 9 Jan 2025 DOI: 10.1016/j.xcrp.2025.102404 Journal Paper I19-Small Molecule Single Crystal Diffraction open access A non-interpenetrated mesoporous hydrogen-bonded organic framework constructed with 1,3,5-tri(4-carboxyphenyl)benzene Peng Cui, Hanyu Zhang
Chemical Communications, Jan 2025 DOI: 10.1039/D4CC06324D Radical-cation salts of BEDT-TTF with tris-coordinated racemic dysprosium(iii) and terbium(iii) anions Emily Howarth, Jordan Lopez, Joseph O. Ogar, Toby J. Blundell, Hiroki Akutsu, Yasuhiro Nakazawa, Shusaku Imajo, Yoshihiko Ihara, Simon J. Coles, Peter N. Horton, Jeppe Christensen, Lee Martin
Dalton Transactions, 104 Jan 2025 DOI: 10.1039/D4DT03484H Journal Paper I19-Small Molecule Single Crystal Diffraction open access A pseudo-cubic metal–organic cage with conformationally switchable faces for dynamically adaptive guest encapsulation Houyang Xu, Tanya K. Ronson, Andrew W. Heard, Paula C. P. Teeuwen, Laura Schneider, Philipp Pracht, John D. Thoburn, David J. Wales, Jonathan R. Nitschke
Nature Chemistry, 8 Jan 2025 DOI: 10.1038/s41557-024-01708-5 Journal Paper I19-Small Molecule Single Crystal Diffraction open access 
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