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Updating NOCI+DFT #42

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fsmoncadaa merged 7 commits intoNOCI+DFTefposadac/openLOWDIN:NOCI+DFTfrom masterefposadac/openLOWDIN:masterCopy head branch name to clipboardNov 22, 2023

+14,841-248

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Commits on Oct 2, 2023

• Adding compatibility to compile with MacOS

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• Merge pull request #34 from efposadac/macos

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Commits on Oct 6, 2023

• to avoid lower/upper case problems, using gawk toupper() function to parse all input options while creating the aux file

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• Fixed errors introduced by last commit. Variables read from input are now uppercase in DFT and output programs.

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• Merge pull request #37 from efposadac/36-input-lowercaseuppercase-sensitivity

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Commits on Nov 21, 2023

• Fixed error #40, caused by fortran strings errors in the NOCI module

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• Merge pull request #41 from efposadac/40-noci-with-three-helium-atoms-didnt-work

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