Efficient separation of small organic contaminants in water using functionalized nanoporous graphene membranes: Insights from molecular dynamics simulations
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Title
Efficient separation of small organic contaminants in water using functionalized nanoporous graphene membranes: Insights from molecular dynamics simulations
Authors
Keywords
Nanoporous graphene, Membrane separation, Water treatment, Organic micropollutant, Molecular dynamics
Journal
JOURNAL OF MEMBRANE SCIENCE
Volume 630, Issue -, Pages 119331
Publisher
Elsevier BV
Online
2021-04-19
DOI
10.1016/j.memsci.2021.119331
References
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Note: Only part of the references are listed.- Characterization of two carbon allotropes, cyclicgraphene and graphenylene, as semi-permeable materials for membranes
- (2020) Rita I. Babicheva et al. Materials Science and Engineering B-Advanced Functional Solid-State Materials
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- (2018) Daiane Damasceno Borges et al. CARBON
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- Strained single-layer C 2 N membrane for efficient seawater desalination via forward osmosis: A molecular dynamics study
- (2018) Bo Liu et al. JOURNAL OF MEMBRANE SCIENCE
- PubChem 2019 update: improved access to chemical data
- (2018) Sunghwan Kim et al. NUCLEIC ACIDS RESEARCH
- Ultrathin graphene-based membrane with precise molecular sieving and ultrafast solvent permeation
- (2017) Q. Yang et al. NATURE MATERIALS
- Molecular dynamics modeling of nano-porous centrifuge for reverse osmosis desalination
- (2017) Tiange Li et al. DESALINATION
- Parametrization of halogen bonds in the CHARMM general force field: Improved treatment of ligand–protein interactions
- (2016) Ignacio Soteras Gutiérrez et al. BIOORGANIC & MEDICINAL CHEMISTRY
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- (2016) Qi Shi et al. JOURNAL OF MATERIALS SCIENCE
- Dynamics of water and solute transport in polymeric reverse osmosis membranes via molecular dynamics simulations
- (2016) Meng Shen et al. JOURNAL OF MEMBRANE SCIENCE
- Interface-Induced Affinity Sieving in Nanoporous Graphenes for Liquid-Phase Mixtures
- (2016) Yanan Hou et al. Journal of Physical Chemistry C
- Removal of heavy metal ions using functionalized graphene membranes: a molecular dynamics study
- (2016) Anitha Kommu et al. RSC Advances
- The Critical Need for Increased Selectivity, Not Increased Water Permeability, for Desalination Membranes
- (2016) Jay R. Werber et al. Environmental Science & Technology Letters
- Rotating carbon nanotube membrane filter for water desalination
- (2016) Qingsong Tu et al. Scientific Reports
- Graphene-based membranes
- (2015) Gongping Liu et al. CHEMICAL SOCIETY REVIEWS
- Development of bacterial cellulose/alginate nanocomposite membrane for separation of ethanol–water mixtures
- (2015) Theerawat Suratago et al. JOURNAL OF INDUSTRIAL AND ENGINEERING CHEMISTRY
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- Dissolved effluent organic matter: Characteristics and potential implications in wastewater treatment and reuse applications
- (2015) I. Michael-Kordatou et al. WATER RESEARCH
- Mechanism of water separation from a gaseous mixture via nanoporous graphene using molecular dynamics simulation
- (2015) Mehdi Darvishi et al. RSC Advances
- Recent advances in nanoporous graphene membrane for gas separation and water purification
- (2015) Chengzhen Sun et al. Science Bulletin
- Submicrometer-Sized ZIF-71 Filled Organophilic Membranes for Improved Bioethanol Recovery: Mechanistic Insights by Monte Carlo Simulation and FTIR Spectroscopy
- (2014) Lik H. Wee et al. ADVANCED FUNCTIONAL MATERIALS
- Mechanical Strength of Nanoporous Graphene as a Desalination Membrane
- (2014) David Cohen-Tanugi et al. NANO LETTERS
- Na+ and K+ ion selectivity by size-controlled biomimetic graphene nanopores
- (2014) Yu Kang et al. Nanoscale
- Biofuel purification in zeolitic imidazolate frameworks: the significant role of functional groups
- (2014) Kang Zhang et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Precise and Ultrafast Molecular Sieving Through Graphene Oxide Membranes
- (2014) R. K. Joshi et al. SCIENCE
- Ultimate Permeation Across Atomically Thin Porous Graphene
- (2014) K. Celebi et al. SCIENCE
- Hydrophilic membranes to replace molecular sieves in dewatering the bio-ethanol/water azeotropic mixture
- (2014) Qian Kang et al. SEPARATION AND PURIFICATION TECHNOLOGY
- What Have We Learnt About the Mechanisms of Rapid Water Transport, Ion Rejection and Selectivity in Nanopores from Molecular Simulation?
- (2014) Michael Thomas et al. Small
- Two-Dimensional Material Membranes: An Emerging Platform for Controllable Mass Transport Applications
- (2014) Yuda Zhao et al. Small
- Alcohol-induced drying of carbon nanotubes and its implications for alcohol/water separation: A molecular dynamics study
- (2013) Xingling Tian et al. JOURNAL OF CHEMICAL PHYSICS
- Simulation Insights for Graphene-Based Water Desalination Membranes
- (2013) Deepthi Konatham et al. LANGMUIR
- Modelling carbon membranes for gas and isotope separation
- (2013) Yan Jiao et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Fundamental water and salt transport properties of polymeric materials
- (2013) Geoffrey M. Geise et al. PROGRESS IN POLYMER SCIENCE
- Automation of the CHARMM General Force Field (CGenFF) II: Assignment of Bonded Parameters and Partial Atomic Charges
- (2012) K. Vanommeslaeghe et al. Journal of Chemical Information and Modeling
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- (2012) K. Vanommeslaeghe et al. Journal of Chemical Information and Modeling
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- (2012) Wenbo Yu et al. JOURNAL OF COMPUTATIONAL CHEMISTRY
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- (2012) Takahiro Fujioka et al. JOURNAL OF MEMBRANE SCIENCE
- Water Desalination across Nanoporous Graphene
- (2012) David Cohen-Tanugi et al. NANO LETTERS
- Selective hydrogen purification through graphdiyne under ambient temperature and pressure
- (2012) Steven W. Cranford et al. Nanoscale
- The Importance of Dehydration in Determining Ion Transport in Narrow Pores
- (2012) Laura A. Richards et al. Small
- A review of water treatment membrane nanotechnologies
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- (2011) Margarida Catarino et al. Innovative Food Science & Emerging Technologies
- The Future of Seawater Desalination: Energy, Technology, and the Environment
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- Chloramination of nitrogenous contaminants (pharmaceuticals and pesticides): NDMA and halogenated DBPs formation
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