An approach to modeling trace component activities in silicate melts: NiO

This report presents a model predicting activities for NiO in a wide range of silicate melts that include the components SiO₂, TiO₂, Al₂O₃, MgO, FeO, CaO, Na₂O, and K₂O. The conceptual simplicity of this model, combined with its success in modeling complex variations in activity with melt composition, suggests that the approach may provide insight into the character of trace components in the melt. The model presented in this report considers NiO to exist as Ni²⁺ and O^2? in the melt, and predicts the activity of NiO by modeling variations in both aNi²⁺ and aO^2?. Activities of Ni²⁺ are modeled assuming that NiO mixes randomly with a hypothetical ‘mixing pool’ of cations dominated by cations of similar size and charge to Ni²⁺, mainly Fe²⁺, Mg²⁺, Ca²⁺, and Ni²⁺. aO^2? is modeled as a function of total oxygen ? 2·network-forming cations, with the understanding that O^2? in silicate melts exists in equilibrium with bridging and non-bridging oxygens through reactions of the type Si–O–Si + O^2? → 2 Si–O. For illustration, the model is applied to reduced mafic lunar samples that may have equilibrated with a Ni-bearing metal phase.