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The pseudo-binary mercury chalcogenide alloy HgSe0.7S0.3 at high pressure: a mechanism of the zinc blende/cinnabar reconstructive phase transition

机译:伪二元汞硫属化物合金Hgse0.7s0.3高   压力:闪锌矿/朱砂重建阶段的机制   过渡

摘要

The structure of the pseudo-binary mercury chalcogenide alloy HgSe0.7S0.3 hasbeen studied by means of X-ray and neutron powder diffraction at pressures upto 8.5 GPa. A phase transition from the cubic zinc blende structure to thehexagonal cinnabar structure was observed at P ~ 1 GPa. A phenomenologicalmodel of this reconstructive phase transition based on the displacementmechanism is proposed. The analysis of the geometrical relationship between thezinc blende and the cinnabar phases has shown that the possible order parameterfor the zinc blende - cinnabar structural transformation is the spontaneousstrain e4. This assignment agrees with the previously observed high pressurebehaviour of the elastic constants of some mercury chalcogenides.
机译:通过X射线和中子粉末衍射在高达8.5 GPa的压力下研究了伪二元汞硫属元素化物HgSe0.7S0.3的结构。在P〜1 GPa处观察到从立方锌混合结构到朱砂结构的相变。提出了基于位移机制的相变相变现象学模型。对锌共混物和朱砂相之间的几何关系的分析表明,锌共混物-朱砂结构转变的可能有序参数是自发应变e4。此分配与先前观察到的某些硫属硫化物的弹性常数的高压行为一致。

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