journal article·2025-09

Enhancing water purification with black phosphorus carbide nanoslits: Insights from molecular dynamics simulations

Xujun Xu, ChenChen Lu, Yue Yu, Junhua Zhao, Ning Wei

Publisher page

Abstract

No abstract is available for this record. The assistant can identify its topic from the title, but cannot infer the study’s results.

Source: Not provided · Quality: missing

Research context

OpenAlex topics: Membrane Separation Technologies · Graphene research and applications · Nanopore and Nanochannel Transport Studies

SciVX discovery tags are terminology-based. OpenAlex topics are source-provided classifications.

References (65)

Show source-provided references
1. A triple increase in global river basins with water scarcity due to future pollution10.1038/s41467-024-44947-3 ↗
2. Timing the first emergence and disappearance of global water scarcity10.1038/s41467-024-51302-z ↗
3. Quantifying spatiotemporal impacts of the interaction of water scarcity and water use by the global semiconductor manufacturing industry
4. Pharmaceuticals wastewater treatment via different advanced oxidation processes: Reaction mechanism, operational factors, toxicities, and cost evaluation – A review10.1016/j.seppur.2024.127458 ↗
5. Single-layer MoS2 nanopores as nanopower generators10.1038/nature18593 ↗
6. The future of seawater desalination: energy, technology, and the environment10.1126/science.1200488 ↗
7. Reverse osmosis hybridization with other desalination techniques: An overview and opportunities10.1016/j.desal.2024.117600 ↗
8. Reverse osmosis desalination: A state-of-the-art review10.1016/j.desal.2019.02.008 ↗
9. A review of reverse osmosis membrane materials for desalination—Development to date and future potential10.1016/j.memsci.2010.12.036 ↗
10. Seawater desalination by reverse osmosis: Current development and future challenges in membrane fabrication – A review10.1016/j.memsci.2021.119292 ↗
11. Molecular dynamics simulation-directed rational design of nanoporous graphitic carbon nitride membranes for water desalination10.1016/j.memsci.2020.118869 ↗
12. A molecular dynamics study on water desalination using single-layer MoSe2 nanopore10.1016/j.memsci.2019.117611 ↗
13. Heterostructured graphene oxide membranes with tunable water-capture coatings for highly selective water permeation10.1039/D1TA00090J ↗
14. Selective Ion Transport in Two-Dimensional Lamellar Nanochannel Membranes
15. Simulation study on real laminar assembly of g-C3N4 high performance free standing membrane with bio-based materials10.1016/j.seppur.2021.119598 ↗
16. Ultrathin Graphene Nanofiltration Membrane for Water Purification10.1002/adfm.201202601 ↗
17. 2D Laminar Membranes for Selective Water and Ion Transport10.1002/adfm.201902014 ↗
18. Large-area graphene-nanomesh/carbon-nanotube hybrid membranes for ionic and molecular nanofiltration10.1126/science.aau5321 ↗
19. Complete steric exclusion of ions and proton transport through confined monolayer water10.1126/science.aau6771 ↗
20. Engineering grain boundaries in monolayer molybdenum disulfide for efficient water-ion separation10.1126/science.ado7489 ↗
21. Deformation constraints of graphene oxide nanochannels under reverse osmosis10.1038/s41467-023-36716-5 ↗
22. Effective ion sieving with Ti3C2Tx MXene membranes for production of drinking water from seawater10.1038/s41893-020-0474-0 ↗
23. Molecular Dynamics Study of Water Flow across Multiple Layers of Pristine, Oxidized, and Mixed Regions of Graphene Oxide10.1021/acsnano.6b08538 ↗
24. Scaling up nanoporous graphene membranes10.1126/science.aax3103 ↗
25. Free-standing graphene slit membrane for enhanced desalination10.1016/j.carbon.2016.09.043 ↗
26. Hexagonal boron nitride with nanoslits as a membrane for water desalination: A molecular dynamics investigation10.1016/j.seppur.2020.117409 ↗
27. Carbon nitride (C3N) nanoslits guided membrane for efficient seawater desalination10.1016/j.apsusc.2022.152460 ↗
28. Investigations on different two-dimensional materials as slit membranes for enhanced desalination10.1016/j.memsci.2019.117653 ↗
29. Exploring the potential of MXene nanoslit for water desalination through molecular dynamics simulations10.1016/j.desal.2023.116560 ↗
30. Improvement of desalination performance by adjusting the arrangement of lamellar MXene membrane10.1016/j.seppur.2023.124265 ↗
31. Molecular insight into water desalination mechanism through g-C3N4 nano-slit membranes: Effect of slit sizes, terminal groups, and number of layers10.1016/j.molliq.2023.123532 ↗
32. Molecular simulation of water permeation and salt rejection for MoS2 nanoslit membranes10.1016/j.desal.2023.116787 ↗
33. Promoting desalination performance of carbon nanotubes through cationic and anionic surface modifications10.1016/j.apsusc.2022.154971 ↗
34. Desalination Performance in Janus Graphene Oxide Channels: Geometric Asymmetry vs Charge Polarity10.1021/acsami.3c16592 ↗
35. Efficient isotropic water desalination in anisotropic lamellar nano-channels formed by layered black phosphorus membrane10.1016/j.desal.2021.114962 ↗
36. Gaganpreet, Self-passivated nanoporous phosphorene as a membrane for water desalination10.1016/j.desal.2020.114777 ↗
37. Ultrafast seawater desalination with phosphorene oxide nanochannel based membrane: Nonmonotonic relationship between oxidation degree and water permeability10.1016/j.desal.2023.116751 ↗
38. Few-Layer Black Phosphorus Carbide Field-Effect Transistor via Carbon Doping10.1002/adma.201700503 ↗
39. Black Phosphorus Carbide as a Tunable Anisotropic Plasmonic Metasurface10.1021/acsphotonics.8b00353 ↗
40. Two-Dimensional Phosphorus Carbide: Competition between sp2 and sp3 Bonding10.1021/acs.nanolett.6b00767 ↗
41. Efficient anisotropic desalination by layer-stacked black phosphorus carbide (α-PC) membrane10.1016/j.desal.2021.115422 ↗
42. Fast Parallel Algorithms for Short-Range Molecular Dynamics10.1006/jcph.1995.1039 ↗
43. VMD: Visual molecular dynamics10.1016/0263-7855(96)00018-5 ↗
44. Titanium Carbide MXene for Water Desalination: A Molecular Dynamics Study, ACS Appl
45. The missing term in effective pair potentials10.1021/j100308a038 ↗
46. Mechanism and thermodynamics of ion selectivity in aqueous solutions of 18-crown-6 ether: a molecular dynamics study10.1021/ja00131a018 ↗
47. P3M3DP—The three-dimensional periodic particle-particle/ particle-mesh program10.1016/0010-4655(80)90052-1 ↗
48. On the performance of vertically aligned graphene array membranes for desalination10.1021/acsami.2c05425 ↗
49. Highly efficient water desalination in carbon nanocones10.1016/j.carbon.2017.12.039 ↗
50. Pyridinic nitrogen doped nanoporous graphene as desalination membrane: Molecular simulation study10.1016/j.memsci.2015.08.052 ↗
51. Multidimensional free-energy calculations using the weighted histogram analysis method10.1002/jcc.540161104 ↗
52. The calculation of the potential of mean force using computer simulations10.1016/0010-4655(95)00053-I ↗
53. A. Grossfield, WHAM: the weighted histogram analysis method, version 2.0. 9, Available at membrane. urmc. rochester. edu/content/wham. Accessed November, 15 (2013) 2013.
54. Water desalination across nanoporous graphene10.1021/nl3012853 ↗
55. Effects of slit width on water permeation through graphene membrane by molecular dynamics simulations10.1038/s41598-017-18688-x ↗
56. Resistance of water transport in carbon nanotube membranes10.1039/C8NR03116A ↗
57. Lamellar water induced quantized interlayer spacing of nanochannels walls, Green
58. Hydrogen-bond kinetics in liquid water10.1038/379055a0 ↗
59. Ultrafast water permeation through nanochannels with a densely fluorous interior surface10.1126/science.abd0966 ↗
60. Molecular simulation study of MoSe2 nanochannel for seawater desalination10.1016/j.memsci.2024.122811 ↗
61. Water Modeled As an Intermediate Element between Carbon and Silicon10.1021/jp805227c ↗
62. Anomalous water transport in narrow-diameter carbon nanotubes10.1073/pnas.2211348119 ↗
63. Ionised graphene oxide membranes for seawater desalination10.1016/j.desal.2020.114637 ↗
64. Machine learning reveals key ion selectivity mechanisms in polymeric membranes with subnanometer pores10.1126/sciadv.abl5771 ↗
65. A review of water treatment membrane nanotechnologies10.1039/c0ee00541j ↗