Alex Granovsky
gran@classic.chem.msu.su
one can check whether the use of -legacy Firefly's 8.0.0 command line
switch results in output files that are more compatible with MacMolPlt.
Kind regards,
Alex Granovsky
On Thu Jan 17 '13 9:50am, Daniil Bratashov wrote
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>On Wed Jan 16 '13 0:28am, Masoud Nahali wrote
>---------------------------------------------
>>>Dear Friends
>>As I have checked the new release of MacMolPlt it can open the output files of Firefly but I simply want to inform and warn you that it shows the structure and the energy of the first SCF NOT the last optimized structure and its energy. Best wishes, m
>If you're using linux vesion of macMolPLt (building from source), you can apply patches from here:
http://slackbuilds.org/repository/14.0/academic/wxmacmolplt
There should be another patch to fix ff8beta incompabilities, but it is not ready yet.
[ This message was edited on Thu Jan 17 '13 at 4:19pm by the author ]