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Determining the mechanisms of deformation in flexible crystals using micro-focus X-ray diffraction

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TLDR
In this paper, a methodology for determining the mechanisms of deformation in flexible crystals with atomic precision is described, and examples where it has been implemented and used for application in the determination of mechanisms of flexibility, but great care must be taken during both experimental design and data analysis.
Abstract
While the first report of molecular crystals that could bend without breaking was well over a decade ago, the development of suitable characterisation tools remains a priority. Due to the broad reaching applications of these materials in advanced technologies, it is important to develop both mechanical and mechanistic understanding. Micro-focused mapping experiments were designed with the intent of bridging the gap between the measurement of mechanical properties and molecular-scale structural understanding. Herein, we describe a methodology for determining the mechanisms of deformation in flexible crystals with atomic precision and provide examples where it has been implemented. Although micro-focused mapping experiments have potential for application in the determination of mechanisms of flexibility, great care must be taken during both experimental design and data analysis.

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Journal ArticleDOI

Elastically flexible molecular crystals.

TL;DR: In this article, an introduction to the underlying mechanical theory and how it may be applied to single crystals is provided, along with a comprehensive discussion on how these mechanical properties can be characterised.
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Dynamic effects in crystalline coordination polymers

TL;DR: In this paper, the authors present the recent scientific developments in the mechanical properties of crystalline coordination polymers (CPs), which have emerged as relatively new crystalline materials in the field of mechanically responsive crystals.
Posted ContentDOI

The mechanism of bending in co-crystals of caffeine and 4-chloro-3-nitrobenzoic acid.

TL;DR: In this paper, a mechanism of elastic bending in co-crystals of caffeine, 4-chloro-3-nitrobenzoic acid and methanol has been determined using micro-focused synchrotron radiation.
Journal ArticleDOI

Research Progress of Mechanically Flexible Molecular Crystals: From Bending Mechanisms to Applications

TL;DR: In this article , the relationship between crystal structure and mechanical properties has not been clearly explored, some explanations for bending can only be given vaguely, and more research are still needed to pave the way for the development of bending principles.
Journal ArticleDOI

Diverse Mechanical Properties of 1,3-Bis(4-nitrophenyl) thiourea–DMSO Dimorphic Solvates

TL;DR: In this paper , a plausible explanation for elastic bending of 1,3-bis(4-nitrophenyl) thiourea-DMSO solvate is presented.
References
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Journal ArticleDOI

Elastic and bendable caffeine cocrystals: implications for the design of flexible organic materials.

TL;DR: A remarkably flexible, elastically bendable cocrystal solvate 1 is reported, formed from caffeine, 4-chloro-3-nitrobenzoic acid, and methanol in a 1:1:< 1 ratio (Figure 1).
Journal ArticleDOI

From Molecules to Interactions to Crystal Engineering: Mechanical Properties of Organic Solids.

TL;DR: This Account describes efforts at focusing down into mechanical properties of organic molecular crystals from the viewpoint of crystal engineering, which is the synthesis and design of functional molecular solids and presents examples where complex properties may be deliberately turned on or off in organic crystals.
Journal ArticleDOI

A meeting with Enrico Fermi

TL;DR: How one intuitive physicist rescued a team from fruitless research with the help of a simple suggestion.
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