Jo. Titiloye et al., ATOMISTIC SIMULATION OF CALCITE SURFACES AND THE INFLUENCE OF GROWTH ADDITIVES ON THEIR MORPHOLOGY, Journal of crystal growth, 131(3-4), 1993, pp. 533-545
Atomistic simulation techniques based on the Born model of solids have
been used to calculate the surface energies and to predict the equili
brium morphology of calcite crystals. The influence of Mg2+, Li+ and H
pO42- ion additives on the surface stability is reported. These result
s can be used to infer the effect on nucleation, and on the growth mor
phologies of calcite.