Investigating the function and design of molecular materials through terahertz vibrational spectroscopy

被引:45
作者
Banks, Peter A. [1 ]
Kleist, Elyse M. [1 ]
Ruggiero, Michael T. [1 ]
机构
[1] Univ Vermont, Dept Chem, Burlington, VT 05405 USA
基金
美国国家科学基金会;
关键词
METAL-ORGANIC FRAMEWORKS; TIME-DOMAIN SPECTROSCOPY; PULSED SPECTROSCOPY; CHARGE-TRANSPORT; PHARMACEUTICAL COCRYSTALS; PHASE-TRANSITIONS; POLYMORPHIC FORMS; BETA-RELAXATION; CRYSTALLINE; DYNAMICS;
D O I
10.1038/s41570-023-00487-w
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
Terahertz spectroscopy has proved to be an essential tool for the study of condensed phase materials. Terahertz spectroscopy probes the low-frequency vibrational dynamics of atoms and molecules, usually in the condensed phase. These nuclear dynamics, which typically involve displacements of entire molecules, have been linked to bulk phenomena ranging from phase transformations to semiconducting efficiency. The terahertz region of the electromagnetic spectrum has historically been referred to as the 'terahertz gap', but this is a misnomer, as there exist a multitude of methods for accessing terahertz frequencies, and now there are cost-effective instruments that have made terahertz studies much more user-friendly. This Review highlights some of the most exciting applications of terahertz vibrational spectroscopy so far, and provides an in-depth overview of the methods of this technique and its utility to the study of the chemical sciences.
引用
收藏
页码:480 / 495
页数:16
相关论文
共 167 条
[41]   Understanding the influence of polymorphism on phonon spectra: Lattice dynamics calculations and terahertz spectroscopy of carbamazepine [J].
Day, GM ;
Zeitler, JA ;
Jones, W ;
Rades, T ;
Taday, PF .
JOURNAL OF PHYSICAL CHEMISTRY B, 2006, 110 (01) :447-456
[42]   Understanding the Origins of Conformational Disorder in the Crystalline Polymorphs of Irbesartan [J].
Delaney, Sean P. ;
Pan, Duohai ;
Galella, Michael ;
Yin, Shawn X. ;
Korter, Timothy M. .
CRYSTAL GROWTH & DESIGN, 2012, 12 (10) :5017-5024
[43]   Quantum-mechanical condensed matter simulations with CRYSTAL [J].
Dovesi, Roberto ;
Erba, Alessandro ;
Orlando, Roberto ;
Zicovich-Wilson, Claudio M. ;
Civalleri, Bartolomeo ;
Maschio, Lorenzo ;
Rerat, Michel ;
Casassa, Silvia ;
Baima, Jacopo ;
Salustro, Simone ;
Kirtman, Bernard .
WILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE, 2018, 8 (04)
[44]   Terahertz interface physics: from terahertz wave propagation to terahertz wave generation [J].
Du, Wanyi ;
Huang, Yuanyuan ;
Zhou, Yixuan ;
Xu, Xinlong .
JOURNAL OF PHYSICS D-APPLIED PHYSICS, 2022, 55 (22)
[45]   Pharmaceutical cocrystals: along the path to improved medicines [J].
Duggirala, Naga K. ;
Perry, Miranda L. ;
Almarsson, Oern ;
Zaworotko, Michael J. .
CHEMICAL COMMUNICATIONS, 2016, 52 (04) :640-655
[46]   PHASE-CHANGES AND CHEMICAL-REACTIONS IN MOLECULAR-CRYSTALS [J].
DUNITZ, JD .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE, 1995, 51 :619-631
[47]   Intermolecular Interaction Energies in Hydroquinone Clathrates at High Pressure [J].
Eikeland, Espen ;
Thomsen, Maja K. ;
Overgaard, Jacob ;
Spackman, Mark A. ;
Iversen, Bo B. .
CRYSTAL GROWTH & DESIGN, 2017, 17 (07) :3834-3846
[48]   On how differently the quasi-harmonic approximation works for two isostructural crystals: Thermal properties of periclase and lime [J].
Erba, A. ;
Shahrokhi, M. ;
Moradian, R. ;
Dovesi, R. .
JOURNAL OF CHEMICAL PHYSICS, 2015, 142 (04)
[49]   Opening the Gate: Framework Flexibility in ZIF-8 Explored by Experiments and Simulations [J].
Fairen-Jimenez, D. ;
Moggach, S. A. ;
Wharmby, M. T. ;
Wright, P. A. ;
Parsons, S. ;
Dueren, T. .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2011, 133 (23) :8900-8902
[50]   Phonons and Adsorption-Induced Deformations in ZIFs: Is It Really a Gate Opening? [J].
Formalik, Filip ;
Mazur, Bartosz ;
Fischer, Michael ;
Firlej, Lucyna ;
Kuchta, Bogdan .
JOURNAL OF PHYSICAL CHEMISTRY C, 2021, 125 (14) :7999-8005