Circumventing a challenging aspect of crystal structure determination from powder diffraction data

por Harris, Kenneth D. M.
Publicado 2022

Exploiting powder X-ray diffraction for direct structure determination in structural biology: The P2X4 receptor trafficking motif YEQGL

por Fujii, Kotaro, Young, Mark T., Harris, Kenneth D.M.
Publicado 2011

A phenomenological model for structural phase transitions in incommensurate alkane/urea inclusion compounds

por Couzi, Michel, Guillaume, François, Harris, Kenneth D. M.
Publicado 2018

“CLASSIC NMR”: An In-Situ NMR Strategy for Mapping the Time-Evolution of Crystallization Processes by Combined Liquid-State and Solid-State Measurements**

por Hughes, Colan E, Williams, P Andrew, Harris, Kenneth D M
Publicado 2014

Controlling Spatial Distributions of Molecules in Multicomponent Organic Crystals, with Quantitative Mapping by Confocal Raman Microspectrometry

por Palmer, Benjamin A., Le Comte, Annaïg, Harris, Kenneth D.M., Guillaume, François
Publicado 2013

Reply to comment on Couzi et al. (2018): a phenomenological model for structural phase transitions in incommensurate alkane/urea inclusion compounds

por Christensen, Kirsten, Williams, P. Andrew, Patterson, Rhian, Palmer, Benjamin A., Couzi, Michel, Guillaume, François, Harris, Kenneth D. M.
Publicado 2019

Solid-State Structural Properties of Alloxazine Determined from Powder XRD Data in Conjunction with DFT-D Calculations and Solid-State NMR Spectroscopy: Unraveling the Tautomeric I...

por Smalley, Christopher J. H., Logsdail, Andrew J., Hughes, Colan E., Iuga, Dinu, Young, Mark T., Harris, Kenneth D. M.
Publicado 2021

Determination of a complex crystal structure in the absence of single crystals: analysis of powder X-ray diffraction data, guided by solid-state NMR and periodic DFT calculations,...

por Hughes, Colan E., Reddy, G. N. Manjunatha, Masiero, Stefano, Brown, Steven P., Williams, P. Andrew, Harris, Kenneth D. M.
Publicado 2017

Exploiting in situ NMR to monitor the formation of a metal–organic framework

por Jones, Corey L., Hughes, Colan E., Yeung, Hamish H.-M., Paul, Alison, Harris, Kenneth. D. M., Easun, Timothy L.
Publicado 2020

Exploiting solid-state dynamic nuclear polarization NMR spectroscopy to establish the spatial distribution of polymorphic phases in a solid material

por Cousin, Samuel F., Hughes, Colan E., Ziarelli, Fabio, Viel, Stéphane, Mollica, Giulia, Harris, Kenneth D. M., Pinon, Arthur C., Thureau, Pierre
Publicado 2023

Unraveling the Complex Solid-State Phase Transition Behavior of 1-Iodoadamantane, a Material for Which Ostensibly Identical Crystals Undergo Different Transformation Pathways

por Al Rahal, Okba, Kariuki, Benson M., Hughes, Colan E., Williams, P. Andrew, Xu, Xiaoyan, Gaisford, Simon, Iuga, Dinu, Harris, Kenneth D. M.
Publicado 2023

Exploiting the Synergy of Powder X-ray Diffraction and Solid-State NMR Spectroscopy in Structure Determination of Organic Molecular Solids

por Dudenko, Dmytro V., Williams, P. Andrew, Hughes, Colan E., Antzutkin, Oleg N., Velaga, Sitaram P., Brown, Steven P., Harris, Kenneth D. M.
Publicado 2013

Monitoring Crystallization Processes in Confined Porous Materials by Dynamic Nuclear Polarization Solid-State Nuclear Magnetic Resonance

por Juramy, Marie, Chèvre, Romain, Cerreia Vioglio, Paolo, Ziarelli, Fabio, Besson, Eric, Gastaldi, Stéphane, Viel, Stéphane, Thureau, Pierre, Harris, Kenneth D. M., Mollica, Giulia
Publicado 2021

Orbital Mapping of Semiconducting Perylenes on Cu(111)

por Di Santo, Giovanni, Miletić, Tanja, Schwendt, Mathias, Zhou, Yating, Kariuki, Benson M., Harris, Kenneth D. M., Floreano, Luca, Goldoni, Andrea, Puschnig, Peter, Petaccia, Luca, Bonifazi, Davide
Publicado 2021

Boron Nitride-Doped Polyphenylenic Organogels

por Dosso, Jacopo, Oubaha, Hamid, Fasano, Francesco, Melinte, Sorin, Gohy, Jean-François, Hughes, Colan E., Harris, Kenneth D. M., Demitri, Nicola, Abrami, Michela, Grassi, Mario, Bonifazi, Davide
Publicado 2022

Rationalization of the X-ray photoelectron spectroscopy of aluminium phosphates synthesized from different precursors

por Bemmer, Victoria, Bowker, Michael, Carter, James H., Davies, Philip R., Edwards, Lee E., Harris, Kenneth D. M., Hughes, Colan E., Robinson, Fiona, Morgan, David J., Thomas, Matthew G.
Publicado 2020

Nitrogen and Hydrogen Adsorption by an Organic Microporous Crystal**

por Msayib, Kadhum J, Book, David, Budd, Peter M, Chaukura, Nhamo, Harris, Kenneth D M, Helliwell, Madeleine, Tedds, Steven, Walton, Allan, Warren, John E, Xu, Mingcan, McKeown, Neil B
Publicado 2009

Ab initio random structure searching of organic molecular solids: assessment and validation against experimental data

por Zilka, Miri, Dudenko, Dmytro V., Hughes, Colan E., Williams, P. Andrew, Sturniolo, Simone, Franks, W. Trent, Pickard, Chris J., Yates, Jonathan R., Harris, Kenneth D. M., Brown, Steven P.
Publicado 2017

Manometric real-time studies of the mechanochemical synthesis of zeolitic imidazolate frameworks

por Brekalo, Ivana, Yuan, Wenbing, Mottillo, Cristina, Lu, Yuneng, Zhang, Yuancheng, Casaban, Jose, Holman, K. Travis, James, Stuart L., Duarte, Frédéric, Williams, P. Andrew, Harris, Kenneth D. M., Friščić, Tomislav
Publicado 2020

A structure determination protocol based on combined analysis of 3D-ED data, powder XRD data, solid-state NMR data and DFT-D calculations reveals the structure of a new polymorph o...

por Smalley, Christopher J. H., Hoskyns, Harriet E., Hughes, Colan E., Johnstone, Duncan N., Willhammar, Tom, Young, Mark T., Pickard, Christopher J., Logsdail, Andrew J., Midgley, Paul A., Harris, Kenneth D. M.
Publicado 2022