Drużbicki Kacper, Gaboardi Mattia, Fernandez-Alonso Felix
Materials Physics Center, CSIC-UPV/EHU, Paseo Manuel de Lardizabal 5, 20018 Donostia-San Sebastian, Spain.
Polish Academy of Sciences, Center of Molecular and Macromolecular Studies, Sienkiewicza 112, 90-363 Lodz, Poland.
Polymers (Basel). 2021 Apr 29;13(9):1440. doi: 10.3390/polym13091440.
This work provides an up-to-date overview of recent developments in neutron spectroscopic techniques and associated computational tools to interrogate the structural properties and dynamical behavior of complex and disordered materials, with a focus on those of a soft and polymeric nature. These have and continue to pave the way for new scientific opportunities simply thought unthinkable not so long ago, and have particularly benefited from advances in high-resolution, broadband techniques spanning energy transfers from the meV to the eV. Topical areas include the identification and robust assignment of low-energy modes underpinning functionality in soft solids and supramolecular frameworks, or the quantification in the laboratory of hitherto unexplored nuclear quantum effects dictating thermodynamic properties. In addition to novel classes of materials, we also discuss recent discoveries around water and its phase diagram, which continue to surprise us. All throughout, emphasis is placed on linking these ongoing and exciting experimental and computational developments to specific scientific questions in the context of the discovery of new materials for sustainable technologies.
这项工作提供了中子光谱技术及相关计算工具最新进展的概述,用于探究复杂无序材料的结构特性和动力学行为,重点关注软质和聚合物性质的材料。这些进展已经并将继续为不久前还难以想象的新科学机遇铺平道路,尤其受益于从毫电子伏特到电子伏特能量转移的高分辨率、宽带技术的进步。热门领域包括确定和可靠归属支撑软固体和超分子框架功能的低能模式,或在实验室量化迄今未探索的决定热力学性质的核量子效应。除了新型材料类别,我们还讨论了围绕水及其相图的近期发现,这些发现仍不断让我们感到惊讶。在整个过程中,重点是将这些正在进行的、令人兴奋的实验和计算进展与可持续技术新材料发现背景下的特定科学问题联系起来。