Thermal conductivity of dissociating water—an ab initio study
The thermal conductivity of partially dissociated and ionised water is calculated in a large-scale study using density functional theory (DFT)-based molecular dynamics (MD) simulations. In doing so, the required heat current of the nuclei is calculated by mapping the effective particle interactions...
| 出版年: | New Journal of Physics |
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| 第一著者: | |
| フォーマット: | 論文 |
| 言語: | 英語 |
| 出版事項: |
IOP Publishing
2019-01-01
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| 主題: | |
| オンライン･アクセス: | https://doi.org/10.1088/1367-2630/ab0613 |