论文标题
冲击压缩碳氢化合物中钻石的三步形成:分解,物种分离和成核
Three-step Formation of Diamonds in Shock-compressed Hydrocarbons: Decomposition, Species Separation, and Nucleation
论文作者
论文摘要
碳氢的积累和循环决定了冰巨星的化学演化。通过静态和冲击压缩实验验证了碳氢系统中的物种分离和钻石沉淀。然而,上述现象的动态形成过程仍然不足以理解。在这里,梳理深度学习模型,我们证明了钻石通过涉及分解,物种分离和成核程序的三步过程形成。在125 GPA和4590 K的休克条件下,烃被分解为氢和低分子量烷烃(CH4和C2H6),它们从导致C/H物种分离的碳链中逸出。没有C-H键的其余碳原子会积聚并成核形成钻石晶体。发现钻石生长的过程与临界核大小相关,其中动态能屏障起着关键作用。这些用于钻石形成的动态过程对建立冰巨星进化的模型有见地。
The accumulation and circulation of carbon-hydrogen dictate the chemical evolution of ice giant planets. Species separation and diamond precipitation have been reported in carbon-hydrogen systems, verified by static and shock-compression experiments. Nevertheless, the dynamic formation processes for the above-mentioned phenomena are still insufficiently understood. Here, combing deep learning model, we demonstrate that diamonds form through a three-step process involving decomposition, species separation and nucleation procedures. Under shock condition of 125 GPa and 4590 K, hydrocarbons are decomposed to give hydrogen and low-molecular-weight alkanes (CH4 and C2H6), which escape from the carbon chains resulting in C/H species separation. The remaining carbon atoms without C-H bonds accumulate and nucleate to form diamond crystals. The process of diamond growth is found to associated with a critical nucleus size where dynamic energy barrier plays a key role. These dynamic processes for diamonds formation are insightful in establishing the model for ice giant planet evolution.