2026-02-09 東京大学
月面の土壌粒子中に存在している直径数ナノメートルから数十ナノメートルの空隙中でH2Oが形成
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月面土壌の小胞における太陽風誘起H2O生成と保持の分子動力学シミュレーション Molecular dynamics simulations of solar-wind induced H2O formation and retention in vesicles of lunar soil
Daigo Shoji
Scientific Reports Published:09 February 2026
DOI:https://doi.org/10.1038/s41598-025-34389-2
Abstract
Several observations have shown that the lunar surface contains both H2O molecules and OH. One possible origin of these chemical species are implanted solar-wind hydrogen. However, the reaction pathway from hydrogen to H2O remains unclear. Here, we use reactive molecular dynamics simulations to investigate H2O formation at vesicle walls in plagioclase grains. When hydrogen atoms were implanted into plagioclase containing a spherical vesicle, 2–3 times more hydrogen became preferentially trapped at the vesicle wall as OH due to oxygen dangling bonds. The accumulation of OH and subsequent trapping of hydrogen atoms led to the synthesis of H2O molecules. If the trapped hydrogen does not diffuse over several lunar days, which is plausible given the strong bonding energy of the dangling bonds (>5 eV), up to a few wt% of H2O can form near vesicle walls. Furthermore, in vesicles lacking pathways to the outer space, their closed structure inhibits H2O diffusion, consistent with the detection of H2O in Apollo soils.


