Wetting and Diffusion of Water on Pristine and Strained Phosphorene
作者： Ruhong Zhou , Zaixing Yang , Chao Ye , Lin Bi , Wei Zhang
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摘要: Phosphorene, a newly fabricated two-dimensional (2D) nanomaterial, have exhibited promising application prospect in biology. Nonetheless, the wetting and diffusive properties of bio-fluids on phosphorene are still elusive. In this study, using molecular dynamics (MD) simulations, we investigated structural dynamic water pristine strained phosphorene. The MD simulations illustrated that diffusion molecules surface is anisotropic, while strain-enhanced clearly present which arises from strain-induced smooth energy landscape. contact angle droplet nonmonotonic variation with transverse strain. structure stretched was demonstrated to be different longitudinal Moreover, discovered proportional quotient coefficients interfacial water. These findings would offer helpful insights potential ways manipulating transport at nanoscale, future bio-applications
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