摘要
基于Gibbs自由能最小原理,本文利用蚁群算法构建了一个复杂体系化学平衡计算的数值计算模型。该模型嵌入局部搜索算法以提高计算精度,通过蚁群移动以获取全局最优解。通过算法验证计算表明,该模型能够作为一种复杂体系化学平衡计算的方法。
Based on the Gibbs free energy minimization method, we use ant colony algorithm to build a numerical calculation model of chemical equilibrium calculations of complex system. The model is embedded into the local search algorithm to improve precision in calculation and through the colony moved to obtain global optimal solution. Algorithm validation results show that the model can be used as a method of chemical equilibrium calculations of complex system.
出处
《计算机与应用化学》
CAS
CSCD
北大核心
2012年第12期1429-1432,共4页
Computers and Applied Chemistry
关键词
复杂体系化学平衡计算
Gibbs自由能最小原理
蚁群算法
chemical equilibrium calculations of complex system, the Gibbs free energy minimization method, ant colony algorithm
