Designing disorder into crystalline materials

A Simonov, AL Goodwin - Nature Reviews Chemistry, 2020 - nature.com
Crystals are a state of matter characterized by periodic order. Yet, crystalline materials can
harbour disorder in many guises, such as non-repeating variations in composition, atom …

One hundred years of diffuse scattering

TR Welberry, T Weber - Crystallography Reviews, 2016 - Taylor & Francis
Over the 100 years since the discovery of the diffraction of X-rays by crystals, structure
determination based on the analysis of Bragg peaks has grown into a very precise, widely …

Hidden diversity of vacancy networks in Prussian blue analogues

A Simonov, T De Baerdemaeker, HLB Boström… - Nature, 2020 - nature.com
Prussian blue analogues (PBAs) are a diverse family of microporous inorganic solids,
known for their gas storage ability, metal-ion immobilization, proton conduction, and stimuli …

[图书][B] Diffuse X-ray scattering and models of disorder

TR Welberry - 2022 - books.google.com
Diffuse X-ray scattering is a rich source of local structural information over and above that
obtained by conventional crystal structure determination. The main aim of the book is to …

Quantitative three-dimensional local order analysis of nanomaterials through electron diffraction

EM Schmidt, PB Klar, Y Krysiak, P Svora… - Nature …, 2023 - nature.com
Abstract Structure-property relationships in ordered materials have long been a core
principle in materials design. However, the introduction of disorder into materials provides …

How to use X-ray diffraction to elucidate 2D polymerization propagation in single crystals

AD Schlüter, T Weber, G Hofer - Chemical Society Reviews, 2020 - pubs.rsc.org
Covalent long-range ordered (crystalline) sheets called 2D polymers have recently been
synthesized by irradiating single crystals of suitably packed monomers. To have such an …

Temperature dependence of dynamic dipole formation in PbTe

KAU Holm, N Roth, CM Zeuthen, K Tolborg… - Physical Review B, 2020 - APS
PbTe-based thermoelectric materials remain of great interest due to their peculiar dynamic
behavior and high thermoelectric performance. The true structure of pristine PbTe has been …

Kinetic Monte Carlo simulations of organic ferroelectrics

TD Cornelissen, M Biler, I Urbanaviciute… - Physical Chemistry …, 2019 - pubs.rsc.org
Ferroelectrics find broad applications, eg in non-volatile memories, but the switching kinetics
in real, disordered, materials is still incompletely understood. Here, we develop an …

Encoding complexity within supramolecular analogues of frustrated magnets

AB Cairns, MJ Cliffe, JAM Paddison, D Daisenberger… - Nature …, 2016 - nature.com
The solid phases of gold (i) and/or silver (i) cyanides are supramolecular assemblies of
inorganic polymer chains in which the key structural degrees of freedom—namely, the …

On single-crystal total scattering data reduction and correction protocols for analysis in direct space

RJ Koch, N Roth, Y Liu, O Ivashko… - … A: Foundations and …, 2021 - journals.iucr.org
Data reduction and correction steps and processed data reproducibility in the emerging
single-crystal total-scattering-based technique of three-dimensional differential atomic pair …