SearcharxivSearch

arXiv · 2310.05729

Desalination Performance of Nano porous Mos$_2$ Membrane on Different Salts of Saline Water: A Molecular Dynamics Study

Abstract

The freshwater crisis is a growing concern and a pressing problem for the world because of the increasing population, civilization, and rapid industrial growth. The water treatment facilities are able to supply less than 1% of the total water demand. Water desalination can be a potential solution to deal with this alarming issue. Researchers have been exploring for quite some time to find novel nano-enhanced membranes and manufacturing techniques to increase the efficiency of the desalination process. Graphene and graphene modified membranes showed huge potential as desalination membranes for comparatively easier synthesis process and higher ion rejection rate than conventional filter materials. Currently, single-layer Mos$_2$ has been discovered to have the same potential of water permeability and ion rejection rate as graphene membrane in a more energy-efficient way. For almost analogous nano porous structure of the graphene membrane, almost 70% of the higher water flux is obtained from the Mos$_2$ membrane. In this work, it has been shown that nano porous Mos$_2$ membranes provide a promising result for desalinating other salts of seawater alongside NaCl. We have also observed the effect of variations in ions, pore size, and pressure on water permeation and ion rejection rates in the water desalination process. In this study, water permeation increased significantly by increasing the pore area from 20{\AA} to 80{\AA}. The rate of water filtration increases in proportion to both applied pressure and pore size, sacrificing the ion rejection rate for the type of ions studied. A combination of salt ions in the saline water for desalination has also been studied, where the rejection rates for the different ions are separately represented for various applied pressures. For seawater, the Mos$_2$ membrane has showed quite promising performance in the study of ion variation.

Explore related subjects

Keep this discovery

BibTeXRIS

Nudrat Nawal, Md Rashed Nizam, Priom Das, A K M Monjur Morshed. 2023-10-09. Desalination Performance of Nano porous Mos$_2$ Membrane on Different Salts of Saline Water: A Molecular Dynamics Study. https://arxiv.org/abs/2310.05729

Cite the original work for its findings. Save a collection to share your selection of sources.

KEEP EXPLORING

Related papers

Slow Dynamics and the Geometry of Jammed Packings

Saddle points in the energy landscape of granular packings dominate the discrete steepest descent dynamics and ultimately determine the path that an out of mechanical equilibrium packing will follow and the resulting stable minimum that it will find. The saddle points that ultimately determine the resulting minima tend to be low-index saddle points. For models with an analytic energy landscape, such as the $p$-spin model, the steepest descent minimization path is affected by higher-index saddle points, which pull the system towards saddle points of decreasing index before arriving at the minima. Here, we examine the steepest descent minimization path of granular packings and compare them to the $p$-spin model. We show that the granular packing steepest descent minimization paths act like their smooth energy landscape counterparts and get attracted by saddle points. The index versus time curves for all models follow a shifted, stretched exponential. We further show that the shape parameter for the granular packings is unchanged when the energy landscape is modified to become analytic (Gaussian potential in a harmonic well) or non-local (Mari-Krzakala-Kurchan). The $p$-spin, on the other hand, has a significantly larger shape parameter. The reason is not due to the dimensionality, packing fraction, nonanalyticity, or the locality of the Hamiltonian of the models. The exact reason for the discrepancy in the shape parameter is \st{still} an unsolved mystery.

cond-mat.soft

A Phase-Field Study of Desiccation Crack Pattern Maturation under Drying-Wetting Cycles

The characteristic intersection angle of the desiccation crack relaxes from near \ang{90} toward \ang{120} under repeated drying--wetting cycles. However, the theoretical understanding of this relaxation is insufficient, especially the modeling of the drying--wetting cycles. Here we introduce a phase-field model of desiccation fracture, extending the model proposed in previous studies by adding crack healing and a scar effect left by past cracks. By repeating drying--wetting cycles in a finite element simulation, we find that the angle distribution develops a growing peak near \ang{120} as the cycle number increases, consistent with experiments. The standard deviation of the intersection angle from \ang{120} relaxes exponentially with a characteristic time of about 2.85 cycles. These results are consistent with experiments, except that the characteristic time is slightly smaller than the experimental value. Crack energy dominates the total energy and also relaxes exponentially with nearly the same characteristic cycle as the angle relaxation. This decay is driven mainly by a shortening of the effective crack length rather than a change in effective fracture toughness.

cond-mat.soft

Kinetics of ferritin crystal formation and melting in acoustically levitated droplets

Understanding protein crystallization pathways is essential for controlling crystallization in structural biology, materials science, and pharmaceutical applications. Classical nucleation theory does not fully capture crystallization processes for several proteins, including ferritin. Here, we combine acoustic levitation with small- and wide-angle X-ray scattering (SAXS and WAXS) to monitor ferritin crystallization in evaporating aqueous polyethylene glycol (PEG) solutions. Acoustic levitation rapidly drives the droplets through a broad range of protein and polymer concentrations, enabling time-resolved measurements of crystallization during evaporation. The scattering data show that ferritin crystals form during evaporation and subsequently lose their crystalline order upon further dehydration. Varying the PEG molecular weight switches between distinct crystallization pathways: one dominated by attractive protein-protein interactions and another dominated by repulsive interactions and excluded-volume effects. Furthermore, we find that lower molecular weight PEG (1000 g/mol) suppresses the dehydration-induced loss of crystalline order observed for higher molecular weight PEG (6000 g/mol), providing a simple strategy for improving protein crystal stability.

cond-mat.soft