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Hydration properties of alkali and alkaline earth metal ions in aqueous solution: A molecular dynamics study
C Liu, F Min, L Liu, J Chen - Chemical Physics Letters, 2019 - Elsevier
Ion hydration and its effects on water structure in different concentrations were studied using
molecular dynamics (MD). The peak positions and intensity of radius distribution functions …
molecular dynamics (MD). The peak positions and intensity of radius distribution functions …
Structure of the Nearest Environment of Na+, K+, Rb+, and Cs+ Ions in Oxygen-Containing Solvents
PR Smirnov - Russian Journal of General Chemistry, 2020 - Springer
The review generalizes and analyzes published data on different methods of studying
structural characteristics of the solvation environment of alkali metal ions (except for Li+) in …
structural characteristics of the solvation environment of alkali metal ions (except for Li+) in …
Network topology in water nanoconfined between phospholipid membranes
Water provides the driving force for the assembly and stability of many cellular components.
Despite its impact on biological functions, a nanoscale understanding of the relationship …
Despite its impact on biological functions, a nanoscale understanding of the relationship …
“Cation/anion with co-solvation” type high-voltage aqueous electrolyte enabled by strong hydrogen bonding
R Hou, Y Wang, Y Sun, J Lang, S Yang, X Yan - Nano Energy, 2022 - Elsevier
Aqueous electrolytes are important charge transport media in various electrochemical
applications. However, the water splitting seriously limits the operation voltage of aqueous …
applications. However, the water splitting seriously limits the operation voltage of aqueous …
Draw solutions for Forward Osmosis process: Osmotic pressure of binary and ternary aqueous solutions of magnesium chloride, sodium chloride, sucrose and maltose
The objective of the present work is to investigate the behaviour of binary and ternary
aqueous systems, which could be employed in the selection criteria for draw agents (DA) to …
aqueous systems, which could be employed in the selection criteria for draw agents (DA) to …
Molecular dynamics simulation of zinc ion in water with an ab initio based neural network potential
An artificial neural network provides the possibility to develop molecular potentials with both
the efficiency of the classical molecular mechanics and the accuracy of the quantum …
the efficiency of the classical molecular mechanics and the accuracy of the quantum …
Anti-icing properties of a superhydrophobic surface in a salt environment: an unexpected increase in freezing delay times for weak brine droplets
LB Boinovich, AM Emelyanenko… - Physical Chemistry …, 2016 - pubs.rsc.org
Superhydrophobic coatings on the aluminum alloy were fabricated by intensive nanosecond
pulsed laser treatment and chemical surface hydrophobization, which are chemically stable …
pulsed laser treatment and chemical surface hydrophobization, which are chemically stable …
Redefining the concept of hydration water near soft interfaces
Water determines the properties of biological systems. Therefore, understanding the nature
of the mutual interaction between water and biosystems is of primary importance for a proper …
of the mutual interaction between water and biosystems is of primary importance for a proper …
Cation coordination polyhedra lead to multiple lengthscale organization in aqueous electrolytes
Understanding multiple lengthscale correlations in the pair distribution functions (PDFs) of
aq. electrolytes is a persistent challenge. Here, the coordination chemistry of polyoxoanions …
aq. electrolytes is a persistent challenge. Here, the coordination chemistry of polyoxoanions …
Overlap** hydration shells in salt solutions causing non-monotonic Soret coefficients with varying concentration
S Mohanakumar, H Kriegs, WJ Briels… - Physical Chemistry …, 2022 - pubs.rsc.org
We investigate the thermodiffusive properties of aqueous solutions of sodium iodide,
potassium iodide and lithium iodide, using thermal diffusion forced Rayleigh scattering in a …
potassium iodide and lithium iodide, using thermal diffusion forced Rayleigh scattering in a …