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Chemical stability of hydrogen boride nanosheets in water

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DataCite Commons2026-03-12 更新2026-05-04 收录
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https://archive.materialscloud.org/doi/10.24435/materialscloud:sy-7b
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资源简介:
Hydrogen boride sheet is a recently fabricated boron-based two-dimensional nanosheet. For the interest of using it in electronic and catalytic applications, it is important that it has sufficient chemical stability for common substances. In this case, we investigate its chemical stability in water, a common substance in ambient condition and many applications. The study was done using experimental and first-principles method. This record contains the crystal structures, optimized via first-principles calculations that were used in discussing the various properties and interaction between water and hydrogen boride sheet. Additionally, input files used to calculate for the systems were included to aid in reproducing results of the study.
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Materials Cloud
创建时间:
2025-06-24
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