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Proportional scaling molecular dynamics simulations of the wetting experiments of water droplets on ink-patterned printing paper
In experiments, printing paper is imprinted with three different ink micropatterns (square, grid, and stripe). The wetting contact angle of water droplets on a heterogeneous surface is then investigated using a proportionate scaling molecular dynamics (MD) simulation, where the water droplets and th...
Autores principales: | , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
The Royal Society of Chemistry
2023
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10630934/ https://www.ncbi.nlm.nih.gov/pubmed/38025861 http://dx.doi.org/10.1039/d3ra05921a |
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author | Wang, Xiao Chen, Lijun Zhang, Chunlai Zhang, Xiping Wu, Yintao Wang, Bo |
author_facet | Wang, Xiao Chen, Lijun Zhang, Chunlai Zhang, Xiping Wu, Yintao Wang, Bo |
author_sort | Wang, Xiao |
collection | PubMed |
description | In experiments, printing paper is imprinted with three different ink micropatterns (square, grid, and stripe). The wetting contact angle of water droplets on a heterogeneous surface is then investigated using a proportionate scaling molecular dynamics (MD) simulation, where the water droplets and the ink-patterned printing paper are both shrunk by a factor of 200 000 collectively. The errors from the theoretical values are always less than 1°, which is much less than the bias of experimental measurement data, according to the modeling contact angles. It has been demonstrated that this proportionate scaling approach works well to appropriately explain the interaction between micro-/nanostructures and liquids. |
format | Online Article Text |
id | pubmed-10630934 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2023 |
publisher | The Royal Society of Chemistry |
record_format | MEDLINE/PubMed |
spelling | pubmed-106309342023-11-08 Proportional scaling molecular dynamics simulations of the wetting experiments of water droplets on ink-patterned printing paper Wang, Xiao Chen, Lijun Zhang, Chunlai Zhang, Xiping Wu, Yintao Wang, Bo RSC Adv Chemistry In experiments, printing paper is imprinted with three different ink micropatterns (square, grid, and stripe). The wetting contact angle of water droplets on a heterogeneous surface is then investigated using a proportionate scaling molecular dynamics (MD) simulation, where the water droplets and the ink-patterned printing paper are both shrunk by a factor of 200 000 collectively. The errors from the theoretical values are always less than 1°, which is much less than the bias of experimental measurement data, according to the modeling contact angles. It has been demonstrated that this proportionate scaling approach works well to appropriately explain the interaction between micro-/nanostructures and liquids. The Royal Society of Chemistry 2023-11-08 /pmc/articles/PMC10630934/ /pubmed/38025861 http://dx.doi.org/10.1039/d3ra05921a Text en This journal is © The Royal Society of Chemistry https://creativecommons.org/licenses/by-nc/3.0/ |
spellingShingle | Chemistry Wang, Xiao Chen, Lijun Zhang, Chunlai Zhang, Xiping Wu, Yintao Wang, Bo Proportional scaling molecular dynamics simulations of the wetting experiments of water droplets on ink-patterned printing paper |
title | Proportional scaling molecular dynamics simulations of the wetting experiments of water droplets on ink-patterned printing paper |
title_full | Proportional scaling molecular dynamics simulations of the wetting experiments of water droplets on ink-patterned printing paper |
title_fullStr | Proportional scaling molecular dynamics simulations of the wetting experiments of water droplets on ink-patterned printing paper |
title_full_unstemmed | Proportional scaling molecular dynamics simulations of the wetting experiments of water droplets on ink-patterned printing paper |
title_short | Proportional scaling molecular dynamics simulations of the wetting experiments of water droplets on ink-patterned printing paper |
title_sort | proportional scaling molecular dynamics simulations of the wetting experiments of water droplets on ink-patterned printing paper |
topic | Chemistry |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10630934/ https://www.ncbi.nlm.nih.gov/pubmed/38025861 http://dx.doi.org/10.1039/d3ra05921a |
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