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DONG Qian; YAN Xinjian; XU Zhihong
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董茜; 严新建; 许志宏
Institute of Chemical Metallurgy, Academia Sinica, Beijing
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Abstract: Based on the group contribution method of Rihani and Doraiswamy, a program system has been set up for automatically analyzing structures and computing ideal gas heat capacities. The method was verifled by using evaluated literature data of 479 organic compounds. The assessment of its computing precision and applicability has been made and some new group parameters recommended.
摘要： Based on the group contribution method of Rihani and Doraiswamy, a program system has been set up for automatically analyzing structures and computing ideal gas heat capacities. The method was verifled by using evaluated literature data of 479 organic compounds. The assessment of its computing precision and applicability has been made and some new group parameters recommended.
DONG Qian, YAN Xinjian, XU Zhihong. STUDY AND IMPROVEMENT OF RIHANI-DORAISWAMY ESTIMATION METHOD FOR Cp° WITH COMPUTER PROGRAM[J]. .
董茜, 严新建, 许志宏. STUDY AND IMPROVEMENT OF RIHANI-DORAISWAMY ESTIMATION METHOD FOR Cp° WITH COMPUTER PROGRAM[J]. CIESC Journal.
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