Research Data Leeds Repository

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Anamari Mohandas, Reshma and Freeman, Joshua R. and Davies, A. Giles and Linfield, Edmund and Dean, Paul and Ponnampalam, Lalitha and Fice, Martyn and Seeds, Alwyn J. and Cannard, Paul J. and Robertson, Michael J. and Moodie, David G. and Rosamond, Mark C. and Natrella, Michele (2017) Dataset for ‘Terahertz generation mechanism in nano-grating electrode photomixers on Fe doped InGaAsP’.²⁰ University of Leeds. [Dataset] https://doi.org/10.5518/132²¹

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Berrow, Stuart and Raistrick, Thomas and Mandle, Richard and Gleeson, Helen (2024) Dataset associated with "Structure-Property Relationships in Auxetic Liquid Crystal Elastomers – The Effect of Spacer Length".²² University of Leeds. [Dataset] https://doi.org/10.5518/1449²³

Brown, Christa P. and Hughes, Matt D. G. and Mahmoudi, Najet and Brockwell, David J. and Coletta, P. Louise and Peyman, Sally A. and Evans, Stephen D. and Dougan, Lorna (2023) Encapsulation of Microbubbles within Folded Protein Hydrogels: Effects on the mechanical and structural properties.²⁴ University of Leeds. [Dataset] https://doi.org/10.5518/1212²⁵

Bushby, Richard J. and Bramble, Jonathan P. and Tate, Daniel J. and Evans, Stephen D. and Lydon, John E. (2021) Alternating Defects and Egg and Dart Textures in De-wetted Stripes of Discotic Liquid Crystal.²⁶ University of Leeds. [Dataset] https://doi.org/10.5518/1037²⁷

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Chappell, Helen and Brooks, Rebecca and Morris, Rhiannon and Smith, James and Pereira, Dora and Powell, Jonathan (2024) IHAT Surface Modelling.²⁸ University of Leeds. [Dataset] https://doi.org/10.5518/1296²⁹

Cookson, Nikki J. and Fowler, Jonathan and Martin, David P. and Fisher, Julie and Henkelis, James J. and Ronson, Tanya K. and Thorp-Greenwood, Flora and Willans, Charlotte E. and Hardie, Michaele (2017) Metallo-cryptophane cages from cis-linked and trans-linked strategies.³⁰ University of Leeds. [Dataset] https://doi.org/10.5518/226³¹

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Dougan, Lorna and Lenton, Samuel and Rhys, Natasha and Towey, James and Soper, Alan (2017) Perchlorate neutron data.³² University of Leeds. [Dataset] https://doi.org/10.5518/210³³

Dunn, Thomas and Skaanvik, Sebastian A. and McPherson, Ian J. and O'Shaughnessy, Cedrick and He, Xuefeng and Kulak, Alexander N. and Micklethwaite, Stuart and Matamoros-Veloza, Adriana and Sandei, Ilaria and Hunter, Liam and Turner, Thomas and Galloway, Johanna M. and Rosenthal, Martin and Britton, Andrew J. and Walker, Marc and Dong, Mingdong and Unwin, Patrick R. and Meldrum, Fiona C. (2024) The Universality of Hair as a Nucleant: Exploring the Effects of Surface Chemistry and Topography.³⁴ University of Leeds. [Dataset] https://doi.org/10.5518/1382³⁵

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Green, David (2019) Dataset for Skin-deep Patterning of Calcite.³⁶ University of Leeds. [Dataset] https://doi.org/10.5518/615³⁷

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Halcrow, Malcolm A. and Burrows, Kay E. and Kulmaczewski, Rafał and Cespedes, Oscar and Barrett, Simon A. (2018) Data to support study of the speciation of homochiral and heterochiral diastereomers of homoleptic cobalt(II) and zinc(II) PyBox complexes.³⁸ University of Leeds. [Dataset] https://doi.org/10.5518/370³⁹

Halcrow, Malcolm A. and Burrows, Kay E. and McGrath, Sarah E. and Kulmaczewski, Rafał and Cespedes, Oscar and Barrett, Simon A. (2017) Data to support study of Spin States of Homochiral and Heterochiral Isomers of [Fe(PyBox)2]2+ Derivatives.⁴⁰ University of Leeds. [Dataset] https://doi.org/10.5518/184⁴¹

Halcrow, Malcolm A. and Capel Berdiell, Izar and Davies, Daniel J. and Woodworth, Jack and Kulmaczewski, Rafał and Cespedes, Oscar (2021) Data to support study of The Structures and Spin States of Iron(II) Complexes of Isomeric 2,6-Di(1,2,3-triazolyl)pyridine Ligands.⁴² University of Leeds. [Dataset] https://doi.org/10.5518/1042⁴³

Halcrow, Malcolm A. and Capel Berdiell, Izar and Desplanches, Cédric and Hochdörffer, Tim and Kulmaczewski, Rafał and Wolny, Juliusz A. and Warriner, Stuart L. and Shahid, Namrah and Cespedes, Oscar and Schünemann, Volker (2019) Data to support study of Supramolecular Iron Metallocubanes Exhibiting Site-Selective Thermal and Light-Induced Spin-Crossover.⁴⁴ University of Leeds. [Dataset] https://doi.org/10.5518/735⁴⁵

Halcrow, Malcolm A. and Capel Berdiell, Izar and Farmiloe, Sarah E. and Kulmaczewski, Rafał (2019) Data to support study of Molecular Squares, Coordination Polymers and Mononuclear Complexes Supported by 2,4-Dipyrazolyl-6H-1,3,5-triazine and 4,6-Dipyrazolylpyrimidine Ligands.⁴⁶ University of Leeds. [Dataset] https://doi.org/10.5518/734⁴⁷

Halcrow, Malcolm A. and Capel Berdiell, Izar and García-López, Víctor and Howard, Mark J. and Clemente-León, Miguel (2021) Data to support study of The Effect of Tether Groups on the Spin States of Iron(II)/Bis[2,6-Di(pyrazol-1-yl)pyridine] Complexes.⁴⁸ University of Leeds. [Dataset] https://doi.org/10.5518/986⁴⁹

Halcrow, Malcolm A. and Capel Berdiell, Izar and Kulak, Alexander N. and Warriner, Stuart L. (2018) Data to support study of Heterometallic Coordination Polymer Gels Supported by 2,4,6-Tris(Pyrazol-1-yl)-1,3,5-Triazine.⁵⁰ University of Leeds. [Dataset] https://doi.org/10.5518/537⁵¹

Halcrow, Malcolm A. and Capel Berdiell, Izar and Kulmaczewski, Rafał (2017) Data to support study of Iron(II) Complexes of 2,4-Dipyrazolyl-1,3,5-Triazine Derivatives ‒ the Influence of Ligand Geometry on Metal Ion Spin State.⁵² University of Leeds. [Dataset] https://doi.org/10.5518/213⁵³

Halcrow, Malcolm A. and Capel Berdiell, Izar and Kulmaczewski, Rafał and Cespedes, Oscar (2017) Data to support study of An Incomplete Spin-Transition Associated with a Z’ = 1 to Z’ = 24 Crystallographic Symmetry Breaking.⁵⁴ University of Leeds. [Dataset] https://doi.org/10.5518/274⁵⁵

Halcrow, Malcolm A. and Capel Berdiell, Izar and Kulmaczewski, Rafał and Namrah, Shahid and Cespedes, Oscar (2021) Data to support study of The Number and Shape of Lattice Solvent Molecules Controls Spin-Crossover in an Isomorphous Series of Crystalline Solvate Salts.⁵⁶ University of Leeds. [Dataset] https://doi.org/10.5518/999⁵⁷

Halcrow, Malcolm A. and Capel Berdiell, Izar and Kulmaczewski, Rafał and Warriner, Stuart L. and Cespedes, Oscar (2020) Data to support study of Iron and Silver Complexes of 4-(Imidazol-1-yl)-2,6-di(pyrazol-1-yl)pyridine (L), Including a [Fe3(mu-F)2F6L8]+ Assembly.⁵⁸ University of Leeds. [Dataset] https://doi.org/10.5518/895⁵⁹

Halcrow, Malcolm A. and Capel Berdiell, Izar and Pask, Christopher M. and Kulmaczewski, Rafał (2019) Data to support study of the Relationship Between Molecular Structure and Switching Temperature in a Library of Spin-Crossover Molecular Materials.⁶⁰ University of Leeds. [Dataset] https://doi.org/10.5518/622⁶¹

Halcrow, Malcolm A. and Capel Berdiell, Izar and Warriner, Stuart L. (2018) Data to support study of silver(I) complexes of bis- and tris-(pyrazolyl)azine derivatives – dimers, coordination polymers and a pentametallic assembly.⁶² University of Leeds. [Dataset] https://doi.org/10.5518/346⁶³

Halcrow, Malcolm A. and Galadzhun, Iurii and Capel Berdiell, Izar and Shahid, Namrah (2019) Data to support study of An Iron(II) Coordination Polymer of a Triazolyl Tris-Heterocycle Showing a Spin State Conversion Triggered by Loss of Lattice Solvent.⁶⁴ University of Leeds. [Dataset] https://doi.org/10.5518/728⁶⁵

Halcrow, Malcolm A. and Galadzhun, Iurii and Kulmaczewski, Rafał and Cespedes, Oscar (2021) Data to support study of Iron/2,6-Di(pyrazol-1-yl)pyridine Derivatives with a Discotic Pattern of Alkyl or Alkynyl Substituents.⁶⁶ University of Leeds. [Dataset] https://doi.org/10.5518/1001⁶⁷

Halcrow, Malcolm A. and Galadzhun, Iurii and Kulmaczewski, Rafał and Cespedes, Oscar and Yamada, Mihoko and Yoshinari, Nobuto and Konno, Takumi (2018) Data to support study of 2,6-Di(pyrazol-1-yl)pyridine-4-carboxylate Esters with Alkyl Chain Substituents, and their Iron(II) Complexes.⁶⁸ University of Leeds. [Dataset] https://doi.org/10.5518/455⁶⁹

Halcrow, Malcolm A. and Galadzhun, Iurii and Kulmaczewski, Rafał and Shahid, Namrah and Cespedes, Oscar (2021) Data to support study of The Flexibility of Long Chain Substituents Influences Spin-Crossover in Isomorphous Lipid Bilayer Crystals.⁷⁰ University of Leeds. [Dataset] https://doi.org/10.5518/974⁷¹

Halcrow, Malcolm A. and Greatorex, Sam and Fokin, Sergey V. and Kulmaczewski, Rafał and Cespedes, Oscar and Yamada, Mihoko and Yoshinari, Nobuto and Konno, Takumi and Sproules, Stephen and Ovcharenko, Victor I. (2020) Data to support study of Modulating the Magnetic Properties of Copper(II)/Nitroxyl Heterospin Complexes by Suppression of the Jahn-Teller Distortion.⁷² University of Leeds. [Dataset] https://doi.org/10.5518/591⁷³

Halcrow, Malcolm A. and Greatorex, Sam and Vincent, Kevin B. and Baldansuren, Amgalanbaatar and McInnes, Eric J. L. and Patmore, Nathan J. and Sproules, Stephen (2019) Data to support study of Rigidification of a Macrocyclic Tris-Catecholate Scaffold Leads to Electronic Localisation of its Mixed Valent Redox Product.⁷⁴ University of Leeds. [Dataset] https://doi.org/10.5518/557⁷⁵

Halcrow, Malcolm A. and Kulmaczewski, Rafał and Armstrong, Isaac T. and Catchpole, Pip and Ratcliffe, Emily S. J. and Babu Vasili, Hari and Warriner, Stuart L. and Cespedes, Oscar (2022) Data to support study of Di-Iron(II) [2+2] Helicates of Bis-(Dipyrazolylpyridine) Ligands – the Influence of the Ligand Linker Group on Spin State Properties.⁷⁶ University of Leeds. [Dataset] https://doi.org/10.5518/1205⁷⁷

Halcrow, Malcolm A. and Kulmaczewski, Rafał and Bamiduro, Faith and Cespedes, Oscar (2020) Data to support study of Structural transformations and spin-crossover in [FeL2]2+ salts (L = 4-{tertbutylsulfanyl}-2,6-di{pyrazol-1-yl}pyridine) − the influence of bulky ligand substituents.⁷⁸ University of Leeds. [Dataset] https://doi.org/10.5518/910⁷⁹

Halcrow, Malcolm A. and Kulmaczewski, Rafał and Cespedes, Oscar (2017) Data to support study of Gradual Thermal Spin-Crossover Mediated by a Re-Entrant Z’ = 1 to Z’ = 6 to Z’ = 1 Phase Transition.⁸⁰ University of Leeds. [Dataset] https://doi.org/10.5518/164⁸¹

Halcrow, Malcolm A. and Kulmaczewski, Rafał and Howard, Mark J. (2021) Data to support study of Influence of Ligand Substituent Conformation on the Spin State of an Iron(II)/Di(pyrazol-1-yl)pyridine Complex.⁸² University of Leeds. [Dataset] https://doi.org/10.5518/961⁸³

Halcrow, Malcolm A. and Kulmaczewski, Rafał and Kershaw Cook, Laurence J. and Pask, Christopher M. and Cespedes, Oscar (2022) Data to support study of Iron(II) Complexes of 4-(Alkyldisulfanyl)-2,6-di(pyrazolyl)pyridine Derivatives. Correlation of Spin-Crossover Cooperativity with Molecular Structure Following Single-Crystal-to-Single-Crystal Desolvation.⁸⁴ University of Leeds. [Dataset] https://doi.org/10.5518/1098⁸⁵

Halcrow, Malcolm A. and Kulmaczewski, Rafał and Trzop, Elzbieta and Collet, Eric and Vela, Sergi (2020) Data to support study of Structure:Function Relationships for Thermal and Light-Induced Spin-Crossover in Isomorphous Molecular Materials.⁸⁶ University of Leeds. [Dataset] https://doi.org/10.5518/820⁸⁷

Halcrow, Malcolm A. and Kulmaczewski, Rafał and Trzop, Elzbieta and Kershaw Cook, Laurence J. and Collet, Eric and Chastanet, Guillaume (2017) Data to support study of Role of Symmetry Breaking in the Structural Trapping of Light-Induced Excited Spin States.⁸⁸ University of Leeds. [Dataset] https://doi.org/10.5518/292⁸⁹

Halcrow, Malcolm A. and Pask, Christopher M. and Greatorex, Sam and Kulmaczewski, Rafał and Baldansuren, Amgalanbaatar and McInnes, Eric J. L. and Bamiduro, Faith and Yamada, Mihoko and Yoshinari, Nobuto (2020) Data to support study of Elucidating the Structural Chemistry of a Hysteretic Iron(II) Spin-Crossover Compound From its Copper(II) and Zinc(II) Congeners.⁹⁰ University of Leeds. [Dataset] https://doi.org/10.5518/773⁹¹

Halcrow, Malcolm A. and Shahid, Namrah and Burrows, Kay E. and Howard, Mark J. and Pask, Christopher M. and Cespedes, Oscar and McGowan, Patrick C. (2021) Data to support study of The Spin States of Diastereomeric Iron(II)/Bis[2,6-Di(thiazolin-2-yl)-pyridine] (ThioPyBox) Complexes, and a Comparison with the Corresponding PyBox Derivatives.⁹² University of Leeds. [Dataset] https://doi.org/10.5518/1028⁹³

Halcrow, Malcolm A. and Shahid, Namrah and Burrows, Kay E. and Pask, Christopher M. and Cespedes, Oscar and Howard, Mark J. and McGowan, Patrick C. (2022) Data to support study of Heteroleptic Iron(II) Complexes of Chiral 2,6-Bis(oxazolin-2-yl)-pyridine (PyBox) and 2,6-Bis(thiazolin-2-yl)pyridine Ligands ‒ the Interplay of Two Different Ligands on the Metal Ion Spin State.⁹⁴ University of Leeds. [Dataset] https://doi.org/10.5518/1113⁹⁵

Hardie, Michaele and Arkawazi, Hayder and Clowes, Rob and Cooper, Andrew and Konno, Takumi and Kuwamura, Naoto and Pask, Christopher M. (2018) Data to support study "Complex phase behavior and structural transformations of metal-organic frameworks with mixed rigid and flexible bridging ligands".⁹⁶ University of Leeds. [Dataset] https://doi.org/10.5518/468⁹⁷

Hardie, Michaele and Britton, Edward and Ansell, Richard J. and Howard, Mark J. (2021) Palladium azo cages.⁹⁸ University of Leeds. [Dataset] https://doi.org/10.5518/1025⁹⁹

Hardie, Michaele and Fowler, Jonathan and Britton, Edward and Pask, Christopher M. and Willans, Charlotte E. (2019) Data to support "Cyclotriveratrylene-tethered trinuclear palladium(II)-NHC com-plexes; reversal of site selectivity in Suzuki-Miyaura reactions".¹⁰⁰ University of Leeds. [Dataset] https://doi.org/10.5518/716¹⁰¹

Hardie, Michaele and Fowler, Jonathan and Thorp-Greenwood, Flora and Willans, Charlotte E. and Warriner, Stuart L. (2016) M12L8 metallo-supramolecular cube with cyclotriguaiacylene-type ligand: spontaneous resolution of cube and its constituent host ligand.¹⁰² University of Leeds. [Dataset] https://doi.org/10.5518/87¹⁰³

Hardie, Michaele and Oldknow, Samuel and Rota Martir, Diego and Pritchard, Victoria and Blitz, Mark A. and Fishwick, Colin and Zysman-Colman, Eli (2018) Data to support study "Structure-switching M3L2 Ir(III) coordination cages with photo-isomerising azo-aromatic groups".¹⁰⁴ University of Leeds. [Dataset] https://doi.org/10.5518/438¹⁰⁵

Hardie, Michaele and Pritchard, Victoria and Thorp-Greenwood, Flora and Coogan, Michael (2016) Data to support study of synthesis and characterisation of rhenium tricarbonyl polypyridine-functionalised cyclotriguaiacyclene ligands.¹⁰⁶ University of Leeds. [Dataset] https://doi.org/10.5518/65¹⁰⁷

Hardie, Michaele and Thorp-Greenwood, Flora and Berry, Gilberte Therese and Boyadjieva, Sophia and Oldknow, Samuel (2018) Data to support study "2D networks of metallo-capsules and other coordination polymers from a hexapodal ligand".¹⁰⁸ University of Leeds. [Dataset] https://doi.org/10.5518/399¹⁰⁹

Hardie, Michaele and Thorp-Greenwood, Flora and Brennan, Alexander and Oldknow, Samuel and Henkelis, James J. and Simmons, Katie and Fishwick, Colin (2016) Data to support study of synthesis of pseudorotaxanes from pillar[5]arene and cyclotriguaiacyclene-type axles.¹¹⁰ University of Leeds. [Dataset] https://doi.org/10.5518/123¹¹¹

Hardie, Michaele and Thorp-Greenwood, Flora and Howard, Mark J. and Kuhn, Lars (2019) Data to support study 'Fully collapsed “imploded” cryptophanes in solution and the solid state'.¹¹² University of Leeds. [Dataset] https://doi.org/10.5518/543¹¹³

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Kendrick, John and Burnett, Andrew (2019) Data associated with Exploring the Reliability of DFT Calculations of the Infrared and Terahertz Spectra of Sodium Peroxodisulfate.¹¹⁴ University of Leeds. [Dataset] https://doi.org/10.5518/606¹¹⁵

Kim, Yi-Yeoun (2016) Dataset for 'Strain-Relief by Single Dislocation Loops in Calcite Crystals Grown on Self-Assembled Monolayers'.¹¹⁶ University of Leeds. [Dataset] https://doi.org/10.5518/53¹¹⁷

Kim, Yi-Yeoun (2016) Dataset for 'Tuning hardness in calcite by incorporation of amino acids'.¹¹⁸ University of Leeds. [Dataset] https://doi.org/10.5518/46¹¹⁹

Kim, Yi-Yeoun and Freeman, Colin L. and Gong, Xiuqing and Levenstein, Mark A. and Wang, Yunwei and Kulak, Alexander N. and Anduix-Canto, Clara and Lee, Phillip A. and Li, Shunbo and Chen, Li and Christenson, Hugo K. and Meldrum, Fiona C. (2017) The effect of additives on the early stages of growth of calcite single crystals - dataset.¹²⁰ University of Leeds. [Dataset] https://doi.org/10.5518/239¹²¹

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Lehman, Julia and Lewandowski, Heather J. and Roberts, Frances (2020) A Rapid, Spatially Dispersive Frequency Comb Spectrograph aimed at Gas Phase Chemical Reaction Kinetics - dataset.¹²² University of Leeds. [Dataset] https://doi.org/10.5518/718¹²³

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Michaels, Evridiki and Capel Berdiell, Izar and Vasili, Hari Babu and Pask, Christopher M. and Howard, Mark J. and Cespedes, Oscar and Halcrow, Malcolm A. (2022) Data to support study of Spin-Crossover in a New Iron(II)/Di(pyrazolyl)pyridine Complex with a Terpyridine Embrace Lattice.¹²⁴ University of Leeds. [Dataset] https://doi.org/10.5518/1229¹²⁵

N

Nguyen, Thai T. H. and Rosbottom, Ian and Marziano, Ivan and Hammond, Robert and Roberts, Kevin J. (2017) Crystal Morphology and Interfacial Stability of RS-Ibuprofen in Relation to Its Molecular and Synthonic Structure dataset.¹²⁶ University of Leeds. [Dataset] https://doi.org/10.5518/189¹²⁷

P

Potter, David G. and Blitz, Mark A. and Seakins, Paul W. (2019) Data for A Generic Method for Determining R + O2 Rate Parameters via OH Regeneration.¹²⁸ University of Leeds. [Dataset] https://doi.org/10.5518/601¹²⁹

Potter, David G. and Wiseman, Scott and Blitz, Mark A. and Seakins, Paul W. (2018) Dataset for 'Laser Photolysis Kinetic Study of OH Radical Reactions with Methyl tert-Butyl Ether and Trimethyl Orthoformate under Conditions Relevant to Low Temperature Combustion: Measurements of Rate Coefficients and OH Recycling'.¹³⁰ University of Leeds. [Dataset] https://doi.org/10.5518/479¹³¹

R

Raistrick, Thomas and Mandle, Richard and Zhang, Zhaopeng and Tipping, Peter and Gleeson, Helen (2024) Dataset associated with 'Order-disorder behavior in the ferroelectric nematic phase investigated via Raman spectroscopy'.¹³² University of Leeds. [Dataset] https://doi.org/10.5518/1491¹³³

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Taylor, Alexander I. P. and Xu, Yong and Wilkinson, Martin and Chakraborty, Pijush and Brinkworth, Alice and Willis, Leon and Zhuravleva, Anastasia and Ranson, Neil A. and Foster, Richard and Radford, Sheena E. (2025) Data for 'Kinetic Steering of Amyloid Formation'.¹³⁴ University of Leeds. [Dataset] https://doi.org/10.5518/1604¹³⁵

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Vergara-Temprado, Jesús and Holden, Mark and Orton, Thomas R. and O'Sullivan, Daniel and Umo, Nsikanabasi S. and Browse, Jo and Reddington, Carly L. and Baeza-Romero, María Teresa and Jones, Jenny M. and Lea-Langton, Amanda and Williams, Alan and Carslaw, Ken S. and Murray, Benjamin J. (2018) Is black carbon an unimportant ice-nucleating particle in mixed-phase clouds? Dataset.¹³⁶ University of Leeds. [Dataset] https://doi.org/10.5518/310¹³⁷

W

Wright, Megan and Warriner, Stuart L. and Field, Devon and White, Jack (2023) FPR1 photoaffinity probe - associated data.¹³⁸ University of Leeds. [Dataset] https://doi.org/10.5518/1226¹³⁹