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Cu0.8Mg1.2Si2O6 : a copper-bearing silicate with the low-clinopyroxene structure

机译:CU0.8MG1.2SI2O6:含有低冠状铜结构的铜硅酸盐

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摘要

The Cu0.8Mg1.2Si2O6 pyroxene has been synthesized using a soft chemistry method. Its crystal structure was determined from powder X-ray diffraction data. Cu0.8Mg1.2Si2O6 crystallizes with the low-clinopyroxene monoclinic structure (space group P2(1)/c). The role of the Jahn-Teller-distorted Cu2+ cation on the stability of this strongly distorted structure is investigated. Cu2+ shows a strong preference for the M2 site, attributed to a better adaptation of its JT-distorted coordination polyhedron to this already distorted and more flexible site. Comparison with previously reported compounds indicates that increasing the Cu content enhances the M2 site distortion, eventually leading to symmetry lowering from orthorhombic Pbca to monoclinic P2(1)/c. These observations bring new insight into the mechanisms of formation and chemical composition of pyroxene minerals in the presence of JT cations.
机译:使用软化学法合成了Cu0.8mg1.2SI2O6辉石。 其晶体结构由粉末X射线衍射数据确定。 CU0.8MG1.2SI2O6用低斜瓣单斜石结构结晶(空间组P2(1)/ c)。 研究了Jahn-externer - 扭曲的Cu2 +阳离子对这种强烈扭曲结构的稳定性的作用。 Cu2 +显示了对M2位点的强烈偏好,归因于更好地适应其JT扭曲的协调多面体对此已经失真并且更灵活的位点。 与先前报道的化合物的比较表明,增加Cu含量增强了M2位点变形,最终导致从正交PBCA降低到单斜晶P2(1)/ c的对称性。 这些观察结果在JT阳离子存在下对柚子矿物质的形成和化学成分的机制带来了新的洞察力。

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