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JOURNAL OF MOLECULAR LIQUIDS · 2019 · IF 4.561

Discriminative ionic capabilities on hydrogen-bond transition from the mode of ordinary water to (Mg, Ca, Sr)(Cl, Br)2 hydration

Hengxin Fang,Zhixu Tang,Xinjuan Liu,Yongli Huang,Chang Q. Sun

It has been a long pursuit to discriminate the ionic roles of mono- and di-valent salt solutions in modulating the hydrogen bonding network and solution properties. We attended this issue by examining the effect of concentrated YX 2 (Y Mg, Ca, Sr; X Cl, Br) solvation on O:H O bonds transition from the mode of ordinary water to hydration in terms of the number fraction f YX2 ( C ) and the segmental O:H O bond phonon stiffness shift Δω(C) with C being the solute concentration. The invariant df Y ( C ) /  dC at C ≤ <0.05 suggests that the small Y 2+ forms a constantly-sized hydration droplet with weak responding to interference of other ions because its hydrating H 2 O dipoles screen mostly its electric field. However, the number inadequacy of the highly-ordered hydrating H 2 O dipoles partially screens the large X − . The X −  ↔ X − electrostatic repulsion weakens its electric field. The concentration-trend consistency of the f YX2 ( C ), the solution conductivity σ YX2 ( C ), and surface stress (contact angle) θ YX2 ( C ) for YX 2 solutions clarifies their common origin of ionic polarization. However, the Jones–Dale notion disobedience of the viscosity η YX2 ( C ) suggests the dominance of the inter-ion repulsion.

研究领域: 物理化学 · 材料科学
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