Hu Huixin, Kuzovnikov Mikhail A, Shuttleworth Hannah A, Marqueño Tomas, Yan Jinwei, Osmond Israel, Gorelli Federico A, Gregoryanz Eugene, Dalladay-Simpson Philip, Ackland Graeme J, Peña-Alvarez Miriam, Howie Ross T
Center for High Pressure Science and Technology Advanced Research, Shanghai, China.
School of Physics and Astronomy, Centre for Science at Extreme Conditions, University of Edinburgh, Edinburgh, UK.
Commun Mater. 2025;6(1):193. doi: 10.1038/s43246-025-00899-9. Epub 2025 Aug 21.
The HSe molecule and the van der Waals compound (HSe)H are both unstable upon room temperature compression, dissociating into their constituent elements above 22 GPa. Through a series of high pressure-high temperature diamond anvil cell experiments, we report the unexpected formation of a novel compound, SeH(H) at pressures above 94 GPa. X-ray diffraction reveals the metallic sublattice to adopt a tetragonal (4/ ) structure with density functional theory calculations finding a small distortion due to the orientation of H molecules. The structure comprises of a network of zig-zag H-Se chains with quasi-molecular H molecular units hosted in the prismatic Se interstices. Electrical resistance measurements demonstrate that SeH(H) is non-metallic up to pressures of 148 GPa. Investigations into the Te-H system up to pressures of 165 GPa and 2000 K yielded no compound formation. The combined results suggest that the high pressure phase behavior of each chalcogen hydride is unique and more complex than previously thought.
HSe分子和范德华化合物(HSe)H在室温压缩下均不稳定,在22吉帕以上会分解为其组成元素。通过一系列高压-高温金刚石对顶砧实验,我们报告了在94吉帕以上压力下意外形成的一种新型化合物SeH(H)。X射线衍射显示金属亚晶格采用四方(4/ )结构,密度泛函理论计算发现由于H分子的取向存在小的畸变。该结构由锯齿状H-Se链网络组成,棱柱形Se间隙中存在准分子H分子单元。电阻测量表明,SeH(H)在高达148吉帕的压力下是非金属的。对Te-H系统在高达165吉帕和2000 K的压力下进行的研究未产生化合物形成。综合结果表明,每种硫族氢化物的高压相行为是独特的,且比之前认为的更为复杂。