Author Topic: Freeh Module Error  (Read 3984 times)

cschuett

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Freeh Module Error
« on: February 03, 2015, 04:59:02 PM »
Hi,

i am currently trying to calculate thermochemical values using the freeh module. For that sake I performed an optimization of benzene as test molecule and did a frequency calculation afterwards.

After invoking of freeh h with "freeh > freeh.out" in the corresponding folder I end up with the following error message in the output file (whole output file is attached):

 MODTRACE: no modules on stack

  DUE TO USER SIGNAL !
 freeh ended abnormally
 freeh ended abnormally
program stopped.


Can anybody tell me where this error originates from?

Best regards,
Christian

Hauke

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Re: Freeh Module Error
« Reply #1 on: February 03, 2015, 05:38:24 PM »
Hi, freeh is an interactive program (like e.g. define) so you can not just run freeh > freeh.out.

It asks for additional input, see the lines
Code: [Select]
Hit RETURN to accept or enter a different
 integer value.     
in the output you provided.

I usually just use freeh
If you know what you are doing you can of course also pipe the input into freeh
freeh < filewithinputparameters > freeh.out
But therefore you have to be sure that there are no unexpected questions or warnings.
 


cschuett

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Re: Freeh Module Error
« Reply #2 on: February 05, 2015, 09:31:59 AM »
.. well that was stupid on my part.. thank your very much =)