Characterization of two carbon allotropes, cyclicgraphene and graphenylene, as semi-permeable materials for membranes
Two-dimensional carbon-based structures have great potential in water purification. Density functional theory calculations and molecular dynamics simulations are performed to characterize two sp2-carbon allotropes, cyclicgraphene (Gr1) and graphenylene (Gr2), as semi-permeable materials for membrane...
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Main Authors: | Babicheva, Rita I., Dahanayaka, Madhavi, Liu, Bo, Korznikova, Elena A., Dmitriev, Sergey V., Wu, Mao See, Zhou, Kun |
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Other Authors: | School of Mechanical and Aerospace Engineering |
Format: | Article |
Language: | English |
Published: |
2022
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Subjects: | |
Online Access: | https://hdl.handle.net/10356/160959 |
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Institution: | Nanyang Technological University |
Language: | English |
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