If you have problems during the execution of MRCC, please attach the output with an adequate description of your case as well as the followings:
  • the way mrcc was invoked
  • the way build.mrcc was invoked
  • the output of build.mrcc
  • compiler version (for example: ifort -V, gfortran -v)
  • blas/lapack versions
  • as well as gcc and glibc versions

This information really helps us during troubleshooting :)

end_of_file error

  • adamhorvath
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1 week 3 days ago #1542 by adamhorvath
end_of_file error was created by adamhorvath
Dear Developer!

I am trying to calculate an anionic Lewis-pair using LNO-CCSD(T)/aug-cc-pvtz method, and I constantly get the following error. I had a similar error for scf, but I could resolv it using the patches, but for drpa, it still does not work.forrtl: severe (24): end-of-file during read, unit 111, file DFINT_AI.4Image              PC                Routine            Line        Sourcedrpa               00000000086D92D3  Unknown               Unknown  Unknowndrpa               000000000086515B  Unknown               Unknown  Unknowndrpa               000000000086470B  Unknown               Unknown  Unknowndrpa               0000000000852C54  Unknown               Unknown  Unknowndrpa               0000000000845616  Unknown               Unknown  Unknowndrpa               00000000004C1265  Unknown               Unknown  Unknowndrpa               000000000047A5ED  Unknown               Unknown  Unknowndrpa               0000000000407A56  Unknown               Unknown  Unknowndrpa               000000000040284D  Unknown               Unknown  Unknowndrpa               000000000877E37A  Unknown               Unknown  Unknowndrpa               0000000008780265  Unknown               Unknown  Unknowndrpa               0000000000402725  Unknown               Unknown  Unknown

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  • nagypeter
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1 week 3 days ago #1543 by nagypeter
Replied by nagypeter on topic end_of_file error
Dear Ádám,
thanks for reporting this, however, if you do not upload the output file, it is really hard to suggest anything.
Thanks, Peter

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