Structures of hydrated metal ions in solid state and aqueous solution

I Persson - Liquids, 2022 - mdpi.com
This review article summarizes the reported crystallographically determined structures of
compounds containing a hydrated metal ion and the reported structures of hydrated metal …

Electro-Freezing of Supercooled Water Is Induced by Hydrated Al3+ and Mg2+ Ions: Experimental and Theoretical Studies

L Fuhrman Javitt, S Kalita, KD Dubey… - Journal of the …, 2023 - ACS Publications
This work reports that the octahedral hydrated Al3+ and Mg2+ ions operate within
electrolytic cells as kosmotropic (long-range order-making)“ice makers” of supercooled …

An X-ray and Neutron Scattering Study of Aqueous MgCl2 Solution in the Gigapascal Pressure Range

T Yamaguchi, N Fukuyama, K Yoshida, Y Katayama… - Liquids, 2023 - mdpi.com
The structure of electrolyte solutions under pressure at a molecular level is a crucial issue in
the fundamental science of understanding the nature of ion solvation and association and …

Metal–ring interactions in group 2 ansa-metallocenes: assessed with the local vibrational mode theory

JJ Antonio, E Kraka - Physical Chemistry Chemical Physics, 2024 - pubs.rsc.org
Ansa-metallocenes, a vital class of organometallic compounds, have attracted significant
attention due to their diverse structural motifs and their pivotal roles in catalysis and …

Comparative Investigation of the Microstructure of MgCl2 Aqueous Solutions Using Different X-ray Scattering Sources, Raman Spectroscopy, and Atomistic …

L Fei, M Wang, M Qiao, Y Zhang, A Wang… - The Journal of …, 2023 - ACS Publications
Aqueous solutions of magnesium chloride (MgCl2 (aq)) are often used to test advances in
the theory of electrolyte solutions because they are considered an ideal strong 2: 1 …

Theoretical investigations on the nature of interactions in ions (Li+, Na+, Be2+, Mg2+)-water clusters in the gas phase

A Patla, J Pal, R Subramanian - Molecular Physics, 2024 - Taylor & Francis
The nature of interaction that is present in ion-water (M (H 2 O) n)(M= L i+, N a+, B e 2+, M g
2+)(n= 1–10) clusters are highlighted in the present work. We have used theories of atoms in …

Bridging atomistic simulations and thermodynamic hydration models of aqueous electrolyte solutions

X Wang, SL Clegg, D Di Tommaso - The Journal of Chemical Physics, 2022 - pubs.aip.org
Chemical thermodynamic models of solvent and solute activities predict the equilibrium
behavior of aqueous solutions. However, these models are semi-empirical. They represent …

Dihydrogen Bonding—Seen through the Eyes of Vibrational Spectroscopy

M Freindorf, M McCutcheon, N Beiranvand, E Kraka - Molecules, 2022 - mdpi.com
In this work, we analyzed five groups of different dihydrogen bonding interactions and
hydrogen clusters with an H 3+ kernel utilizing the local vibrational mode theory, developed …

Bridging Molecular and Macroscopic Models of Solution Thermodynamics

X Wang - 2022 - qmro.qmul.ac.uk
Highly concentrated aqueous solutions occur in a variety of natural and engineered
chemical systems, which are far from pure water but rich in ions. The chemical equilibrium …

[PDF][PDF] Structures of Hydrated Metal Ions in Solid State and Aqueous Solution. Liquids 2022, 2, 210–242

I Persson - 2022 - academia.edu
This review article summarizes the reported crystallographically determined structures of
compounds containing a hydrated metal ion and the reported structures of hydrated metal …