The behavior of water confined in MIL-53(Cr), a flexible metal-organic framework (MOF), is investigated through computational infrared spectroscopy. As the number of molecules adsorbed inside of the pores increases, the water OH stretch band of the linear infrared spectrum grows in intensity and approaches that of bulk water. To assess whether the water confined in MIL-53(Cr) becomes liquid-like, two-dimensional infrared spectra (2DIR) are also calculated. Confinement effects result in distinct chemical environments that appear as specific features in the 2DIR spectra. The evolution of the 2DIR line shape as a function of waiting time is well described in terms of the orientational dynamics of the water molecules, with chemical exchange cross peaks appearing at a time scale similar to the hydrogen bond rearrangement lifetime. The confining environment considerably slows the hydrogen bond dynamics relative to bulk as a result of the competition between water-framework and water-water interactions.
Download full-text PDF |
Source |
|---|---|
| http://dx.doi.org/10.1021/jz5013998 | DOI Listing |
Publication Analysis
Top Keywords
Similar Publications
Effect of konjac glucomannan aerogel-immobilized Chlorella vulgaris LH-1 on oil-contaminated seawater remediation and endogenous bacterial community diversity.
Water Environ Res
January 2025
Zhejiang Key Laboratory of Petrochemical Environmental Pollution Control, Zhejiang Ocean University, Zhoushan, P. R. China.
Ocean oil spills can severely impact ecosystems and disrupt marine biodiversity and habitats. Microbial remediation is an effective method for removing thin oil slick contamination. In this study, the adsorption and degradation of low-concentration oil spills by Chlorella vulgaris LH-1 immobilized in konjac glucomannan (KGM) aerogel were investigated.
View Article and Find Full Text PDFDelivering Volumetric Hyperthermia to Head and Neck Cancer Patient-Specific Models Using an Ultrasound Spherical Random Phased Array Transducer.
Bioengineering (Basel)
December 2024
Department of Radiation Oncology, University of California, San Francisco, San Francisco, CA 94115, USA.
In exploring adjuvant therapies for head and neck cancer, hyperthermia (40-45 °C) has shown efficacy in enhancing chemotherapy and radiation, as well as the delivery of liposomal drugs. Current hyperthermia treatments, however, struggle to reach large deep tumors uniformly and non-invasively. This study investigates the feasibility of delivering targeted uniform hyperthermia deep into the tissue using a non-invasive ultrasound spherical random phased array transducer.
View Article and Find Full Text PDFField experiment confirms high macroplastic trapping efficiency of wood jams in a mountain river channel.
Sci Rep
January 2025
Institute of Nature Conservation, Polish Academy of Sciences, al. Adama Mickiewicza 33, 31- 120, Kraków, Poland.
Identifying macroplastic deposition hotspots in rivers is essential for planning cleanup efforts and assessing the risks to aquatic life and the aesthetic value of river landscapes. Recent fieldwork in mountain rivers has shown that wood jams retain significantly more macroplastic than other emergent surfaces within river channels. Here, we experimentally verify these findings by tracking the deposition of 64 PET bottles after 52-65 days of transport in the mid-mountain Skawa River (Polish Carpathians) under low to medium flow conditions.
View Article and Find Full Text PDFMulticooperation of Turtle-inspired amphibious spherical robots.
Sci Rep
January 2025
Electrical and Information Engineering College, Jilin Agricultural Science and Technology University, Jilin, 132109, China.
It is challenging to achieve high-speed and accurate multicooperation of turtle-inspired amphibious spherical robots (ASRs) in turbid water and confined spaces when the robots are underwater movement with multiple degrees of freedom (MDOF). This paper innovatively proposes a control strategy for modelling and experimental platforms that can communicate and cooperate between multiple robots. First, a novel underwater kinematic model using the unit quaternion (UQ) algorithm is proposed based on attitude interpolation to realize MDOF movement.
View Article and Find Full Text PDFFabricating Lattice-Confined Pt Single Atoms With High Electron-Deficient State for Alkali Hydrogen Evolution Under Industrial-Current Density.
Adv Mater
January 2025
State Key Laboratory of Organic-Inorganic Composites and College of Chemical Engineering, Beijing University of Chemical Technology, Beijing, 100029, People's Republic of China.
The confining effect is essential to regulate the activity and stability of single-atom catalysts (SACs), but the universal fabrication of confined SACs is still a great challenge. Here, various lattice-confined Pt SACs supported by different carriers are constructed by a universal co-reduction approach. Notably, Pt single atoms confined in the lattice of Ni(OH) (Pt/Ni(OH)) with a high electron-deficient state exhibit excellent activity for basic hydrogen evolution reaction (HER).
View Article and Find Full Text PDFWant AI Summaries of new PubMed Abstracts delivered to your In-box?
Enter search terms and have AI summaries delivered each week - change queries or unsubscribe any time!