Instruments by Science Group
Macromolecular
Soft Condensed 
Imaging and
Biological
Magnetic
Structures and
Crystallography 
Spectroscopy I15-1 Contact
Beamline Phone Number:
+44 (0) 1235 778144
Principal Beamline Scientist:
Dean Keeble
Tel: +44 (0) 1235 778391
E-mail: [email protected]
XPDF Manual
Science Group Leader
Philip Chater
Email: [email protected]
Tel: +44 (0)1235 778677
I15-1 XPDF: X-ray Pair Distribution Function
Status: Operational
Wavelength: 0.31, 0.19, 0.16 Å
Energy: 40, 65, 76 keV
Energy: 40, 65, 76 keV
These papers are all based at least in part on data gathered on beamline I15-1. If you have published a paper based on data from I15-1 which doesn't appear here, please send a reference (ideally including a DOI) to us.
26 items found for 2023 [total: 263]
Structure, spin correlations, and magnetism of the S = 1/2 square-lattice antiferromagnet Sr2CuTe1–xWxO6 (0 ≤ x ≤ 1) Chemistry Of Materials, 43 Dec 2023 DOI: 10.1021/acs.chemmater.3c02535
Synthesis, structure and properties of bifunctional carboxyphosphonate metal-organic frameworks Dec 2023
Thesis I15-1-X-ray Pair Distribution Function (XPDF)
Fine-tuned photochromic WO3-x thin films: A detailed study from structural analysis to UV photo-sensing application Optical Materials, 145 Nov 2023 DOI: 10.1016/j.optmat.2023.114432
Journal Paper I15-1-X-ray Pair Distribution Function (XPDF)
Ionic conductivity and structure of glasses synthesized by mechanical-milling methods in the x[Na2S]–(100 – x) [0.5GeS2–0.5Ga2S3] system Inorganic Chemistry, 22 Nov 2023 DOI: 10.1021/acs.inorgchem.3c02849
Journal Paper I15-1-X-ray Pair Distribution Function (XPDF)
Effects of quenching and annealing on conductivity and ferroelectric properties of Na0.5Bi0.5TiO3-NaNbO3 ceramics Journal Of The European Ceramic Society, 7 Nov 2023 DOI: 10.1016/j.jeurceramsoc.2023.11.019
Local structure and lithium-ion diffusion pathway of cubic Li7La3Zr2O12 studied by total scattering and the Reverse Monte Carlo method Journal Of Materials Chemistry A, 46 Oct 2023 DOI: 10.1039/D3TA04495E
Interfacial bonding between a crystalline metal–organic framework and an inorganic glass Journal Of The American Chemical Society, 11 Oct 2023 DOI: 10.1021/jacs.3c04248
On the origin of the Non-Arrhenius Na-ion conductivity in Na3OBr Angewandte Chemie International Edition, Oct 2023 DOI: 10.1002/anie.202314444
Journal Paper I11-High Resolution Powder Diffraction I15-1-X-ray Pair Distribution Function (XPDF) open access
Water-aluminum interaction as driving force of Linde Type A aluminophosphate hydration Nanomaterials, 13 Aug 2023 DOI: 10.3390/nano13172387
Atomic-level structure determination of amorphous molecular solids by NMR Nature Communications, 14 Aug 2023 DOI: 10.1038/s41467-023-40853-2
Local order in liquid gallium-indium alloys The Journal Of Physical Chemistry C, 263 Aug 2023 DOI: 10.1021/acs.jpcc.3c03857
Leucopterin, the white pigment in butterfly wings: structural analysis by PDF fit, FIDEL fit, Rietveld refinement, solid-state NMR and DFT-D Iucrj, 10 Jul 2023 DOI: 10.1107/S2052252523004281
Electrochemical lithiation-induced formation of disordered rocksalt Journal Of Materials Chemistry A, 13 Jul 2023 DOI: 10.1039/D3TA01740K
Short- and medium-range structure synergistically control fracture toughness of densified aluminoborate glasses Physical Review Materials, 7 May 2023 DOI: 10.1103/PhysRevMaterials.7.053607
Journal Paper I15-1-X-ray Pair Distribution Function (XPDF)
ZIF-62 glass foam self-supported membranes to address CH4/N2 separations Nature Materials, 345 May 2023 DOI: 10.1038/s41563-023-01545-w
Novel synthetic approach towards large-sized inorganic-organic hybrid glass May 2023
Science Highlight I15-1-X-ray Pair Distribution Function (XPDF)
Entropy driven disorder–order transition of a metal–organic framework with frustrated flexibility Apl Materials, 11 Apr 2023 DOI: 10.1063/5.0144718
Anion-polarisation–directed short-range-order in antiperovskite Li2FeSO Journal Of Materials Chemistry A, Apr 2023 DOI: 10.1039/D2TA10037A
Modulating liquid–liquid transitions and glass formation in zeolitic imidazolate frameworks by decoration with electron-withdrawing cyano groups Journal Of The American Chemical Society, 24 Apr 2023 DOI: 10.1021/jacs.3c01933
Journal Paper I15-1-X-ray Pair Distribution Function (XPDF)
Order and disorder in cerium-rich ceria-zirconia solid solutions revealed from reverse Monte Carlo analysis of neutron and x-ray total scattering Apl Materials, 11 Mar 2023 DOI: 10.1063/5.0139567
An amorphous teflate doped aluminium chlorofluoride: a solid lewis-superacid for the dehydrofluorination of fluoroalkanes Chemcatchem, Mar 2023 DOI: 10.1002/cctc.202300350
Multiple local symmetries result in a common average polar axis in high-strain BiFeO3-based ceramics Physical Review Letters, 130 Feb 2023 DOI: 10.1103/PhysRevLett.130.076801
Study of a local structure at the interface between corrosion films and carbon steel surface in undersaturated CO2 environments Acs Omega, Feb 2023 DOI: 10.1021/acsomega.2c07631
Fabrication of super-sized metal inorganic-organic hybrid glass with supramolecular network via suppressing crystallization approach Angewandte Chemie International Edition, Feb 2023 DOI: 10.1002/anie.202218094
Journal Paper I15-1-X-ray Pair Distribution Function (XPDF)
On the local structure in ordered and disordered closo-hydroborate solid electrolytes The Journal Of Physical Chemistry C, 1413 Jan 2023 DOI: 10.1021/acs.jpcc.2c07835
Noncovalent bonding assessment by Pair Distribution Function Faraday Discussions, Jan 2023 DOI: 10.1039/D2FD00159D
- Otto H. J. Mustonen, Ellen Fogh, Joseph A. M. Paddison, Lucile Mangin-Thro, Thomas Hansen, Helen Y. Playford, Maria Diaz-Lopez, Peter Babkevich, Sami Vasala, Maarit Karppinen, Edmund J. Cussen, Henrik M. Ronnow, Helen C. Walker, "Structure, spin correlations, and magnetism of the S = 1/2 square-lattice antiferromagnet Sr2CuTe1–xWxO6 (0 ≤ x ≤ 1)", Chemistry Of Materials, 43 (2023), DOI: 10.1021/acs.chemmater.3c02535
- [Thesis] Joseph A. Barker, "Synthesis, structure and properties of bifunctional carboxyphosphonate metal-organic frameworks" (2023)
- Yazan Badour, Sylvain Danto, Mathieu Gonidec, Christine Labrugère, Matthew R. Suchomel, Gilles Philippot, Manuel Gaudon, "Fine-tuned photochromic WO3-x thin films: A detailed study from structural analysis to UV photo-sensing application", Optical Materials, 145 (2023), DOI: 10.1016/j.optmat.2023.114432
- Jiajie Zhang, Virginie Nazabal, David Le Coq, Laurent Calvez, Xiang-Hua Zhang, Olivier Hernandez, Gwenhael Duplaix-Rata, Corentin Poidevin, Xavier Rocquefelte, Eric Furet, Louisiane Verger, "Ionic conductivity and structure of glasses synthesized by mechanical-milling methods in the x[Na2S]–(100 – x) [0.5GeS2–0.5Ga2S3] system", Inorganic Chemistry, 22 (2023), DOI: 10.1021/acs.inorgchem.3c02849
- Juncheng Pan, Yizhe Li, Ziqi Yang, David A. Hall, "Effects of quenching and annealing on conductivity and ferroelectric properties of Na0.5Bi0.5TiO3-NaNbO3 ceramics", Journal Of The European Ceramic Society, 7 (2023), DOI: 10.1016/j.jeurceramsoc.2023.11.019
- Haolai Tian, Guanqun Cai, Lei Tan, He Lin, Anthony E. Phillips, Isaac Abrahams, David A. Keen, Dean S. Keeble, Andy Fiedler, Junrong Zhang, Xiang Yang Kong, Martin T. Dove, "Local structure and lithium-ion diffusion pathway of cubic Li7La3Zr2O12 studied by total scattering and the Reverse Monte Carlo method", Journal Of Materials Chemistry A, 46 (2023), DOI: 10.1039/D3TA04495E
- Celia Castillo-Blas, Ashleigh M. Chester, Ronan P. Cosquer, Adam F. Sapnik, Lucia Corti, Roman Sajzew, Bruno Poletto-Rodrigues, Georgina P. Robertson, Daniel J. M. Irving, Lauren N. Mchugh, Lothar Wondraczek, Frédéric Blanc, David A. Keen, Thomas D. Bennett, "Interfacial bonding between a crystalline metal–organic framework and an inorganic glass", Journal Of The American Chemical Society, 11 (2023), DOI: 10.1021/jacs.3c04248
- Brigita D Darminto, Gregory J. Rees, John Cattermull, Kenjiro Hashi, Maria Diaz-Lopez, Naoaki Kuwata, Stephen J. Turrell, Emily Milan, Yvonne Chart, Camilla Di Mino, Hyeong Jeong Lee, Andrew Goodwin, Mauro Pasta, "On the origin of the Non-Arrhenius Na-ion conductivity in Na3OBr", Angewandte Chemie International Edition (2023), DOI: 10.1002/anie.202314444
- Anže Hubman, Janez Volavšek, Tomaž Urbič, Nataša Zabukovec Logar, Franci Merzel, "Water-aluminum interaction as driving force of Linde Type A aluminophosphate hydration", Nanomaterials, 13 (2023), DOI: 10.3390/nano13172387
- Manuel Cordova, Pinelopi Moutzouri, Sten O. Nilsson Lill, Alexander Cousen, Martin Kearns, Stefan T. Norberg, Anna Svensk Ankarberg, James Mccabe, Arthur C. Pinon, Staffan Schantz, Lyndon Emsley, "Atomic-level structure determination of amorphous molecular solids by NMR", Nature Communications, 14 (2023), DOI: 10.1038/s41467-023-40853-2
- Alfred Amon, Philip A. Chater, Gavin Vaughan, Rachael Smith, Christoph G. Salzmann, "Local order in liquid gallium-indium alloys", The Journal Of Physical Chemistry C, 263 (2023), DOI: 10.1021/acs.jpcc.3c03857
- Federica Bravetti, Lukas Tapmeyer, Kathrin Skorodumov, Edith Alig, Stefan Habermehl, Robert Hühn, Simone Bordignon, Angelo Gallo, Carlo Nervi, Michele R. Chierotti, Martin U. Schmidt, "Leucopterin, the white pigment in butterfly wings: structural analysis by PDF fit, FIDEL fit, Rietveld refinement, solid-state NMR and DFT-D", Iucrj, 10 (2023), DOI: 10.1107/S2052252523004281
- Matthew J. A. Leesmith, Nathan R. Halcovitch, Xiao Hua, "Electrochemical lithiation-induced formation of disordered rocksalt", Journal Of Materials Chemistry A, 13 (2023), DOI: 10.1039/D3TA01740K
- Elsebeth J. Pedersen, Theany To, Søren S. Sørensen, Rasmus Christensen, Johan F. S. Christensen, Lars R. Jensen, Michal Bockowski, Oxana V. Magdysyuk, Maria Diaz-Lopez, Yuanzheng Yue, Morten M. Smedskjaer, "Short- and medium-range structure synergistically control fracture toughness of densified aluminoborate glasses", Physical Review Materials, 7 (2023), DOI: 10.1103/PhysRevMaterials.7.053607
- Zibo Yang, Youssef Belmabkhout, Lauren N. Mchugh, De Ao, Yuxiu Sun, Shichun Li, Zhihua Qiao, Thomas D. Bennett, Michael D. Guiver, Chongli Zhong, "ZIF-62 glass foam self-supported membranes to address CH4/N2 separations", Nature Materials, 345 (2023), DOI: 10.1038/s41563-023-01545-w
- [Science Highlight] Diamond Light Source, "Novel synthetic approach towards large-sized inorganic-organic hybrid glass" (2023)
- Roman Pallach, Jan-Benedikt Weiss, Katrin Vollmari, Sebastian Henke, "Entropy driven disorder–order transition of a metal–organic framework with frustrated flexibility", Apl Materials, 11 (2023), DOI: 10.1063/5.0144718
- Samuel W. Coles, Viktoria Falkowski, Harry S. Geddes, Gabriel E. Pérez, Samuel G. Booth, Alexander G. Squires, Conn O'Rourke, Kit Mccoll, Andrew L. Goodwin, Serena A. Cussen, Simon J. Clarke, Saiful Islam, Benjamin J. Morgan, "Anion-polarisation–directed short-range-order in antiperovskite Li2FeSO", Journal Of Materials Chemistry A (2023), DOI: 10.1039/D2TA10037A
- Jianbo Song, Louis Frentzel-Beyme, Roman Pallach, Pascal Kolodzeiski, Athanasios Koutsianos, Wen-Long Xue, Rochus Schmid, Sebastian Henke, "Modulating liquid–liquid transitions and glass formation in zeolitic imidazolate frameworks by decoration with electron-withdrawing cyano groups", Journal Of The American Chemical Society, 24 (2023), DOI: 10.1021/jacs.3c01933
- Aron Summer, Helen Y. Playford, Lewis R. Owen, Janet M. Fisher, Amy Kolpin, David Thompsett, Richard I. Walton, "Order and disorder in cerium-rich ceria-zirconia solid solutions revealed from reverse Monte Carlo analysis of neutron and x-ray total scattering", Apl Materials, 11 (2023), DOI: 10.1063/5.0139567
- Minh Bui, Kurt Hoffmann, Thomas Braun, Sebastian Riedel, Christian Heinekamp, Kerstin Scheurell, Gudrun Scholz, Tomasz M. Stawski, Franziska Emmerling, "An amorphous teflate doped aluminium chlorofluoride: a solid lewis-superacid for the dehydrofluorination of fluoroalkanes", Chemcatchem (2023), DOI: 10.1002/cctc.202300350
- Ge Wang, Tengfei Hu, Wenxuan Zhu, Zhilun Lu, Annette Kleppe, Maria Diaz Lopez, Antonio Feteira, Derek C. Sinclair, Zhengqian Fu, Houbing Huang, Dawei Wang, Ian M. Reaney, "Multiple local symmetries result in a common average polar axis in high-strain BiFeO3-based ceramics", Physical Review Letters, 130 (2023), DOI: 10.1103/PhysRevLett.130.076801
- Adriana Matamoros-Veloza, Tomasz M. Stawski, Silvia Vargas, Anne Neville, "Study of a local structure at the interface between corrosion films and carbon steel surface in undersaturated CO2 environments", Acs Omega (2023), DOI: 10.1021/acsomega.2c07631
- Mohamed. A. Ali, Wessel M. W. Winters, Moushira A. Mohamed, Dezhi Tan, Guojun Zheng, Rasmus S. K. Madsen, Oxana V. Magdysyuk, Maria Diaz-Lopez, Biao Cai, Nan Gong, Yijue Xu, Ivan Hung, Zhehong Gan, Sabyasachi Sen, Hong-Tao Sun, Thomas D. Bennett, Xiaofeng Liu, Yuanzheng Yue, Jianrong Qiu, "Fabrication of super-sized metal inorganic-organic hybrid glass with supramolecular network via suppressing crystallization approach", Angewandte Chemie International Edition (2023), DOI: 10.1002/anie.202218094
- Paul Till, Ryo Asakura, Arndt Remhof, Wolfgang G. Zeier, "On the local structure in ordered and disordered closo-hydroborate solid electrolytes", The Journal Of Physical Chemistry C, 1413 (2023), DOI: 10.1021/acs.jpcc.2c07835
- Lucy K. Saunders, Daniel J. M. Irving, Philip A. Chater, Maria Diaz-Lopez, "Noncovalent bonding assessment by Pair Distribution Function", Faraday Discussions (2023), DOI: 10.1039/D2FD00159D
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