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Supplementary Material for: A New Group-Contribution Approach for Ideal Gas Heat Capacity, Critical Temperature and Normal Boiling Point

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DataCite Commons2026-01-16 更新2026-05-07 收录
下载链接:
https://darus.uni-stuttgart.de/citation?persistentId=doi:10.18419/DARUS-5298
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资源简介:
This dataset contains the substances used in in the related publication (.csv files), the adjusted group contribution parameters for the ideal gas heat capacity, the normal boiling point and the critical temperature, individually adjusted ideal gas heat capacity parameters (.csv files), the first and second order candidate groups (.py files) and python code to calculate the properties.<br> Examplary python notebooks to execute the code are provided. <br> The necessary dependencies/package versions to run the code are provided via the uv-package.
提供机构:
DaRUS
创建时间:
2025-08-20
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