Determination of Vapor Pressure of Chemical Compounds: A Group Contribution Model for an Extremely Large Database

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Gharagheizi, Farhad; Eslamimanesh, Ali; Ilani-Kashkouli, Poorandokht; Mohammadi, Amir H.; Richon, Dominique;
(2012)
  • Publisher: Figshare
  • Related identifiers: doi: 10.1021/ie3002099.s002, doi: 10.1021/ie3002099.s003
  • Subject: Inorganic Chemistry | LM | leverage value statistics method | Neuroscience | 3040 K | 42 000 | optimization algorithm | vapor pressure values | Chemical Compounds | Vapor Pressure | 42 000 vapor pressure values | 1400 chemical compounds | group contribution model | Biophysics | correlation coefficient | AARD
    • FOR: 80699 Information Systems not elsewhere classified | 69999 Biological Sciences not elsewhere classified | 19999 Mathematical Sciences not elsewhere classified | 39999 Chemical Sciences not elsewhere classified

In the present study, a group contribution model is developed for determination of the vapor pressure of pure chemical compounds at temperatures from 55 to 3040 K. About 42 000 vapor pressure values belonging to around 1400 chemical compounds (mostly organic... View more
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