In this paper we present textural and compositional data for columbite group minerals (CGM) and associated Nb-Ta-Sn oxides from lithium-beryllium-tantalum pegmatite deposits of the Kolmozero-Voronja belt, NW Russia, with the aim of deciphering the above mentioned features for minerals from deposits with different mineral signatures and lithium ore grade. Minerals from four deposits, including two of world-class (Kolmozero and Polmostundra), are examined. It is shown that the main controlling factors are the diversity and rate of magmatic fractionation, hydrothermal overprint and mineral paragenesis followed from the specific geochemical signature of the different pegmatite deposits. CGM from Kolmozero include several mineral species (columbite-(Fe), columbite-(Mn), tantalite-(Fe), tantalite-(Mn)) showing large compositional variations, mainly controlled by Nb-Ta fractionation (Ta/(Ta+Nb) = 0.16-0.70; Mn/(Mn + Fe) = 0.45-0.63). Textural patterns are extremely various (oscillatory, homogeneous, patchy, spongy, somewhere with over-growing Ta-rich rims) and indicate the involvement of numerous magmatic and hydrothermal processes. The Polmostundra CGM are represented by columbite-(Fe) with Ta/(Ta+Nb) ranging from 0.05 to 0.39 with homogeneous, mottled, oscillatory, patchy and irregular reverse textures. The Okhmylk CGM are irregular normal, patchy and homogeneous columbite-(Fe) and columbite-(Mn) with Ta/(Ta+Nb) = 0.09-0.24 and Mn/(Mn + Fe) = 0.29-0.92, indicating the suppressed magmatic fractionation and iron drop due to precipitation of Fe minerals. Columbite-(Fe) and columbite-(Mn) from the Be-Ta Shongui deposit are less evolved with Ta/(Ta+Nb) = 0.07-0.23 and Mn/(Mn + Fe) = 0.31-0.55. The minerals are characterized by progressive normal, oscillatory, homogeneous and ir-regular reverse patterns. Associated pyrochlore minerals occur both as early magmatic (Kolmozero) and late hydrothermal (Polmostundra, Okhmylk). Cassiterite is found only in the Okhmylk dykes and is apparently of hydrothermal origin. CGM from Li pegmatites have impurities of Ti (0.01-0.05 apfu) and W (up to 0.02 apfu), whereas CGM from Be pegmatites contains elevated Ti (up to 0.09 apfu). The mineral systems analysis presented here is relevant for exploration.

Pyrochlore group minerals are the main raw phases in granitic rocks of the Katugin complex-ore deposit that stores Nb, Ta, Y, REE, U, Th, Zr, and cryolite. They are of three main generations: primary magmatic (I), early postmagmatic (II), and supergene (III) pyrochlores. The primary magmatic phase (generation I) is fluornatropyrochlore with high concentrations of Na2O (to 10.5 wt.%), F (to 5.4 wt.%) and REE2O3 (to 17.1 wt.%) but low CaO (0.6-4.3 wt.%), UO2 (to 2.6 wt.%), ThO2 (to 1.8 wt.%), and PbO (to 1.4 wt.%). Pyrochlore of this type is very rare in nature and limited to a few occurrences, such as rare-metal deposits of Nechalacho in syenite and nepheline syenite (Canada) and Mariupol in nepheline syenite (Ukraine). It may have crystallized synchronously with or slightly later than melanocratic minerals (aegirine, biotite, and arfvedsonite) at the late magmatic stage when Fe from the melt became bound making impossible the formation of columbite. Second generation pyrochlore formed at the early postmagmatic stage of the Katugin deposit. It differs from that of first generation in lower Na2O concentrations (2.8 wt.%), relatively low F (4 wt.%), and les occupancy of the A and Y sites at similar contents of other components. Generation III pyrochlore is a product of supergene alteration processes. It is compositionally heterogeneous and contains K, Ba, Pb, Fe, and significant Si concentrations but low Na and F. Its compositions mostly fall within the filed of hydro- and kenopyrochlore.

Pyrochlore oxides (A2B2O7) are potential nuclear waste substrate material due to their superior radiation resistance properties. We performed molecular dynamics simulations to study the structural properties and displacement cascades in ytterbium titanate pyrochlore (Yb2Ti2O7). We computed threshold displacement energy ( Ed ) and lattice constant ( ao) of Yb2Ti2O7. The effect of displacement cascades in Yb2Ti2O7 of recoils of energies 1 keV, 2 keV, 5 keV, 10 keV in different crystallographic directions ([100], [110], [111]) were studied. The number of defects is found to be proportional to the energy of incident PKA. Additionally, the Ed of pyrochlore is computed and it exhibits anisotropy. Furthermore, radiation damage in high-entropy pyrochlore (HEPy) i.e., YbYTiZrO7, YbGdTiZrO7 , Yb0.5Y0.5Eu0.5Gd0.5TiZrO7 were investigated and compared with Yb2Ti2O7. It was found that HEPy have a larger Ed as compared with Yb2Ti2O7 which exhibits characteristic of lower radiation damage resistance than HEPy. Our simulation proposed that HEPy alloys are more radiation resistant than individual pyrochlore constituents . This work will provide atomic insights in developing substrate materials for nuclear waste applications.