inline basis set error for molcas7.2 and not for molcas6.4

Posted by loison Claire on December 12, 2008 at 12:54:12:

I tried to run the thiophen excited states
example (manual molcas7.2 page 199) using inline basis set definition. Its works well with molcas6.4, but with molcas7.2 i get an input error from seward looking like this :
-----------------------------------------
Warning: the label 0.0000000 will be truncated to 4 characters!

ERROR IN GET_F: TRYING TO READ 4 VALUES
0.0000000 2
-----------------------------------------

I read the trick with the required
patch level 7.0.198 using the VERBATIM in the discussion forum , but it did not work for me.
I do not know whether the patch was put per default in molcas7.2. Is there a similar patch for molcas7.2 ? Or a different input format ?

Thanks for any help !
Claire Loison

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: I tried to run the thiophen excited states : example (manual molcas7.2 page 199) using inline basis set definition. Its works well with molcas6.4, but with molcas7.2 i get an input error from seward looking like this : : ----------------------------------------- : Warning: the label 0.0000000 will be truncated to 4 characters! : ERROR IN GET_F: TRYING TO READ 4 VALUES : 0.0000000 2 : ----------------------------------------- : I read the trick with the required : patch level 7.0.198 using the VERBATIM in the discussion forum , but it did not work for me. : I do not know whether the patch was put per default in molcas7.2. Is there a similar patch for molcas7.2 ? Or a different input format ? : Thanks for any help ! : Claire Loison

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