CIESC Journal
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周维彪,许志宏
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Zhou Weibiao and Xu Zhihong (Institute of Chemical Metallurgy, ACADEMIA SINICA)
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摘要: 应用非线性规划的共轭梯度投影法,并结合化学平衡相平衡问题的特殊性,本文设计了一个新的多相多组元化学平衡相平衡通用计算方——GCG法.检验表明,它在大多数情况下(特别是对非理想体系)优于现存的RVCS、SVMP和M-SVMP三种通用算法.
Abstract: Based upon the conjugate gradient projection algorithm of nonlinear programming, a new general method-GCG was constructed with two treatments according to the peculiarity of chemical equilibria calculation. The first treatment was that a special relation between iteration and linear searching was set up, according to the ideality of the system. The second was that a method of determining the initial active set in algorithm was designed for equilibria problems. The results of calculation showed that for most non-ideal systems, it was very efficient.
周维彪,许志宏. 多相多组元化学平衡相平衡计算(Ⅱ)——新算法GCG法 [J]. CIESC Journal.
Zhou Weibiao and Xu Zhihong (Institute of Chemical Metallurgy, ACADEMIA SINICA). Calculation of Multicomponent MultiphaseEquilibria (Ⅱ) A New General Method GCG[J]. .
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https://hgxb.cip.com.cn/CN/Y1987/V38/I1/49