| People | Locations | Statistics |
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| Naji, M. |
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| Motta, Antonella |
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| Aletan, Dirar |
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| Mohamed, Tarek |
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| Ertürk, Emre |
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| Taccardi, Nicola |
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| Kononenko, Denys |
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| Petrov, R. H. | Madrid |
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| Alshaaer, Mazen | Brussels |
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| Bih, L. |
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| Casati, R. |
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| Muller, Hermance |
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| Kočí, Jan | Prague |
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| Šuljagić, Marija |
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| Kalteremidou, Kalliopi-Artemi | Brussels |
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| Azam, Siraj |
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| Ospanova, Alyiya |
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| Blanpain, Bart |
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| Ali, M. A. |
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| Popa, V. |
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| Rančić, M. |
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| Ollier, Nadège |
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| Azevedo, Nuno Monteiro |
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| Landes, Michael |
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| Rignanese, Gian-Marco |
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Skelton, Jonathan M.
University of Manchester
in Cooperation with on an Cooperation-Score of 37%
Topics
Publications (30/30 displayed)
- 2024Electronic transport and the thermoelectric properties of donor-doped SrTiO3citations
- 2024Composition-dependent morphologies of CeO2 nanoparticles in the presence of Co-adsorbed H2O and CO2citations
- 2024Composition-dependent morphologies of CeO 2 nanoparticles in the presence of Co-adsorbed H 2 O and CO 2 : a density functional theory studycitations
- 2023Thermoelectric properties of Pnma and R3m GeS and GeSecitations
- 2023A Low‐Temperature Synthetic Route Toward a High‐Entropy 2D Hexernary Transition Metal Dichalcogenide for Hydrogen Evolution Electrocatalysiscitations
- 2023A Low‐Temperature Synthetic Route Toward a High‐Entropy 2D Hexernary Transition Metal Dichalcogenide for Hydrogen Evolution Electrocatalysiscitations
- 2023Breathing Behaviour Modification of Gallium MIL‐53 Metal–Organic Frameworks Induced by the Bridging Framework Inorganic Anioncitations
- 2023Synthetic Strategies toward High Entropy Materials: Atoms-to-Lattices for Maximum Disordercitations
- 2023Enhanced Thermoelectric Performance of Tin(II) Sulfide Thin Films Prepared by Aerosol Assisted Chemical Vapor Depositioncitations
- 2020Polymorph exploration of bismuth stannate using first-principles phonon mode mappingcitations
- 2020Lattice dynamics of Pnma Sn(S1-xSex) solid solutions: energetics, phonon spectra and thermal transportcitations
- 2020Assessment of dynamic structural instabilities across 24 cubic inorganic halide perovskitescitations
- 2020Watching Photochemistry Happencitations
- 2019Thermodynamics, Electronic Structure, and Vibrational Properties of Sn n(S 1- xSe x) m Solid Solutions for Energy Applicationscitations
- 2019Room Temperature Metallic Conductivity in a Metal–Organic Framework Induced by Oxidationcitations
- 2019Thermodynamics, Electronic Structure, and Vibrational Properties of Sn n (S 1– x Se x) m Solid Solutions for Energy Applicationscitations
- 2019Photocrystallographic studies on transition metal nitrito metastable linkage isomers: manipulating the metastable statecitations
- 2018Acoustic phonon lifetimes limit thermal transport in methylammonium lead iodidecitations
- 2018Understanding the fast phase-change mechanism of tetrahedrally bonded Cu 2 GeTe 3 :Comprehensive analyses of electronic structure and transport phenomenacitations
- 2018Understanding the fast phase-change mechanism of tetrahedrally bonded Cu2GeTe3citations
- 2018Hydrogen Bonding versus Entropycitations
- 2017Chemical and Lattice Stability of the Tin Sulfidescitations
- 2016Phonon anharmonicity, lifetimes, and thermal transport in CH 3 NH 3 PbI 3 from many-body perturbation theorycitations
- 2016Phonon anharmonicity, lifetimes, and thermal transport in CH3NH3PbI3 from many-body perturbation theorycitations
- 2016Observation of a re-entrant phase transition in the molecular complex tris(μ2-3,5-diisopropyl-1,2,4-triazolato-κ2N1:N2)trigold(I) under high pressurecitations
- 2016A general forcefield for accurate phonon properties of metal-organic frameworkscitations
- 2016Band alignments, valence bands, and core levels in the tin sulfides SnS, SnS2, and Sn2S3citations
- 2016Computational materials design of crystalline solidscitations
- 2015Influence of the exchange-correlation functional on the quasi-harmonic lattice dynamics of II-VI semiconductorscitations
- 2014Atomistic origin of the enhanced crystallization speed and n-type conductivity in Bi-doped Ge-Sb-Te phase-change materialscitations
Places of action
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booksection
Watching Photochemistry Happen
Abstract
<p>Photoresponsive materials are an important contemporary research area with applications in, for example, energy and catalysis. Mechanistic information on solid-state photochemical reactions has traditionally come from spectroscopy and modelling, with crystallography limited to snapshots of endpoints and long-lived intermediates. Recent advances in X-ray sources and detectors have made it possible to follow solid-state reactions in situ with dynamic single-crystal X-ray diffraction (SCXRD) methods, allowing a full set of atomic positions to be determined over the course of the reaction. These experiments provide valuable structural information that can be used to interpret spectroscopic measurements and to inform materials design and optimisation. Solid-state linkage isomers, where small-molecule ligands such as NO, NO<sub>2</sub><sup>−</sup>, N<sub>2</sub> and SO<sub>2</sub> show photo-induced changes in binding to a transition metal centre, have played a leading role in the development of dynamic SCXRD methodology, since the movement of whole atoms and the predictable temperature dependence of the excited-state lifetimes make them ideal test systems. The field of “photocrystallography”, pioneered by Coppens in the late 1990s, has developed alongside advances in instrumentation and computing and can now provide the 3D structures of species with lifetimes down to femtoseconds. In this chapter, we will review the development of photocrystallography experiments against linkage isomer systems, from the early identification of metastable species under continuous illumination, through measuring kinetics at low temperature, to recent experiments studying species with sub-second lifetimes. We will discuss the advances in X-ray sources and instrumentation that have made dynamic SCXRD experiments possible, and we will highlight the role of kinetic modelling and complementary spectroscopy in designing experiments. Finally, we will discuss possible directions for future development and identify some of the outstanding challenges that remain to be addressed.</p>