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Application of first-principles based techniques for compounds prediction in a gasification plant

机译:基于第一原理的技术在气化厂化合物预测中的应用

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摘要

In this work a first-principles based model for the prediction of the Syngas composition produced in a gasification plant is described. The model design is based on chemical-physical principles of the gasification process and is based on nonlinear static equations. For the formulation of the equations, Gibbs energy minimization of the compound used in the gasification process is taken into account together with computations of material balance.
机译:在这项工作中,描述了基于第一原理的模型,用于预测在气化厂中产生的合成气的组成。该模型设计基于气化过程的化学物理原理,并基于非线性静态方程。对于公式的公式化,考虑了气化过程中所用化合物的吉布斯能量最小化以及材料平衡的计算。

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