md error

Clicked A Few Times

1:14:31 PM PST - Mon, Nov 23rd 2015

hi to everyone i compiled nwchem-6.6 on mac book pro successfully but i am not able to run md examples in every example i found always the same error for example for benzene is:

Created fragment bnz.frg_TMP

Unresolved atom types in fragment bnz

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*   0: pre_mkfrg failed 9999

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0::Received an Error in Communication
application called MPI_Abort(comm=0x84000000, 9999) - process 0

Please can you help me to solve this problem?

Thanks a lot for your patience

Dearly

lorenzo

Clicked A Few Times

5:08:12 PM PST - Tue, Mar 1st 2016
The prepare module was unable to finish building a fragment file for bnz, but provided a file bnz.frg_TMP that you can use to make corrections. If you copy this file, it may be easy to show how to fix this.

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