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matlab求导代码-SeaFreeze:SeaFreeze软件包允许计算0-2300MPa和220-500K范围内的水和冰多晶...
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2021-05-24
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matlab求导代码海冰 V0.9.2 SeaFreeze软件包可以计算0-2300 MPa和220-500K范围内的水和冰多晶型物(Ih,II,III,V和VI)的热力学和弹性性质。 它基于对每个阶段的Gibbs局部基础函数参数化()的评估,该参数被构造为重现热力学测量结果。 在形式化的液体水吉布斯参数化中,以及在形式化的液体水吉布斯参数化中更详细地描述了形式主义。 入门 正在安装 向每个版本(Python或Matlab)的READEME文件报告以安装SeaFreeze。 运行SeaFreeze 本节提供有关如何运行SeaFreeze的基本示例。 它使用的是伪代码,因此synthax将更改所用版本的依赖关系。 输入项 要运行SeaFreeze功能,您需要提供压力(MPa)和温度(K)坐标以及材料输入: out=SeaFreeze(PT,'material') PT是包含压力温度点(MPa和开尔文)的结构(栅格输出)或阵列(散布输出)。 “材料”定义要使用的冰或水。 可能性: “ Ih”代表冰Ih(Feistel和Wagner,2006年) 冰II的'II'(Journaux et a
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