炼油过程分子管理的基础理论研究

项目名称： 炼油过程分子管理的基础理论研究

项目编号： No.U1462206

项目类型： 联合基金项目

立项/批准年度： 2015

项目学科： 数理科学和化学

项目作者： 邱彤

作者单位： 清华大学

项目金额： 300万元

中文摘要： 炼油过程分子管理是实现石油资源向高附加值产品高效分子转化的根本方法，是同时解决原油资源劣质化和环保要求日益严格的组合难题的重要手段。炼油过程高效分子管理作为当前炼油化工发展的方向之一，是一项复杂的系统工程。本项目将针对其中的关键基础理论问题开展研究，提出由油品宏观性质预测油品等效实际分子组成的优化表征方法；通过构建油品加工过程的基元反应动力学网络，揭示油品在分子水平的转化规律；以加氢裂化过程为例，集成油品分子表征、分子转化与过程模型，实现炼油二次加工装置的分子水平模拟；剖析和开发炼油过程中关键的高效分离技术，基于超结构建模方法实现炼油过程高效分离系统的优化；基于分子水平的反应、分离过程研究基础，建立面向炼油过程的多装置联合分子水平管理优化模型，开展分解协调优化算法的研究，为最终实现油品资源的按需、高效、高附加值的全局优化调度提供保证。

中文关键词： 炼油过程；分子管理；等效分子组成；动力学反应网络；全局优化调度

英文摘要： Molecule management for petroleum refining industry is an opportunity for efficient conversion at molecular level from crude oil to high value-added products, and also can solve the problem caused by the resource degradation under stricter environmental regulations. Implementing molecule management for refining, as one of the modern development directions in the petroleum industry, is complex system engineering. In this project several fundamental theories for molecule management in the refining process will be studied. First, a characterization method for predicting equivalent molecular composition of any petroleum fraction will be proposed based on available analytical information. Then the transformation rules of petroleum fractions will be revealed by developing free-radical kinetic reaction networks. As an integrated example, the molecular level simulation for the hydrocracking process will be performed based on the detailed composition characterization analysis. Further, an innovative and critical separation technology in refining process will be analyzed and developed, and the separation sequence by superstructure modeling will be optimized. Finally, the optimization model of the molecule management of multiple operating units in the refinery will be built. This model is a multi-layered structure system and will be solved by developing a new decomposition-coordination algorithm. The outputs of this proposal will build a solid theoretical foundation for the on-demand, on-time production planning optimization of modernized refineries in China.

英文关键词： Petroleum refining;Molecule management;Equivalent molecular compositions;Kinetic reaction network;Global optimization and scheduling