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Looks like there is a typo in rate rules file #96

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@PengZhang13

Location: RMG-database\input\kinetics\families\H_Abstraction\rules.py
Line: 2038 / Entry 205
“E0 = (1.45, 'kcal/mol') “

I think it should be a negative value as -1.45

I checked the source literature.
It looks like the parameters for this entry are taken from the rate for i-Butane T000 site.
They were written as logA = 3.41, n = 1.9, B = -730 in the original paper.
Then we have B*1.987/1000= -1.45
So maybe it's a typo in the rate rules file?

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  1. changed the title [-]Looks like a typo in rate rules file[/-] [+]Looks like there is a typo in rate rules file[/+] on Apr 14, 2016
  2. connie commented on Apr 14, 2016

    @connie
    Member

    Probably is a typo if the original paper says so. Can you make the edit and create a pull request with link to the literature source?

  3. nyee commented on Jun 15, 2016

    @nyee
    Contributor

    Fixed with #101

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