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Restricting Solvation to Two Dimensions: Soft Landing of Microsolvated Ions on Inert Surfaces

机译:限制溶剂化到两个尺寸:惰性表面上微渗透压离子的软着陆

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In an effort to scrutinize dimensional restriction effects on finite hydrogen-bonded networks, we deposit ion-doped water clusters by computational soft landing on a chemically inert supported xenon surface. In stark contrast to the much studied metal or metal oxide surfaces, the rare gas surface interacts only rather weakly and nondirectionally with these networks. Surprisingly, the strongly bound Na~(+)-doped networks undergo very significant plastic deformations, whereas the weakly bound Cl~(–) counterparts barely change upon surface deposition. This counterintuitive finding is traced back to the significantly less favorable water–water interactions enforced by the cation, which results in an easier adaption to geometric restrictions, whereas H-bonding stabilizes the anionic clusters.
机译:努力审查对有限氢键网络的尺寸限制效应,通过在化学惰性支撑的氙表面上计算软着陆沉积离子掺杂的水簇。 在与所学习的金属或金属氧化物表面的鲜明对比中,稀有气体表面仅与这些网络相互作用,并且与这些网络相互作用。 令人惊讶的是,强烈的Na〜(+) - 掺杂网络经历了非常显着的塑性变形,而弱结合的Cl〜( - )对应物几乎没有改变表面沉积。 该违反思考的发现追溯到阳离子强制执行的显着较低的水 - 水相互作用,这导致对几何限制的更容易适应,而H键合稳定阴离子簇。

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