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In the reactive crystallization of lithium carbonate, molecular dynamics simulations are performed for crystal faces of lithium carbonate in contact with sodium chloride‐water molecules. A modified attachment energy model, accounting for the Connolly surface, spacing between crystal faces and solvent molecules, is applied to predict the morphological importance of crystal surface in solvent. From...
The kinetic Monte Carlo simulations were used to study the nucleation and growth mechanism of GaAs. The Ehrlich–Schwoebel (ES) barrier has an important effect on the growth mechanism. It was shown that the island density mainly depends on the growth temperature: low island density for high temperature, and high island density for low temperature. The islands in the second layer appear at small surface...
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