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Pariser parr#139

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giovanni-br wants to merge 38 commits intotheochem:maintheochem/ModelHamiltonian:mainfrom giovanni-br:PariserParrgiovanni-br/ModelHamiltonian:PariserParrCopy head branch name to clipboard

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Commits on Jun 10, 2024

• add CI to PariserParr branch

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• Merge pull request theochem#121 from RichRick1/PariserParr

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Commits on Jun 13, 2024

• changing the matrix Sxy

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Commits on Jun 14, 2024

• Pariser Parr

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Commits on Jul 1, 2024

• theochem#116 Fixing logic of orbital_overlap

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Commits on Jul 2, 2024

• Merge branch 'issue-116-fix' of https://github.com/giovanni-br/ModelHamiltonian into giovanni-br-issue-116-fix

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• Merge pull request theochem#126 from theochem/giovanni-br-issue-116-fix

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Commits on Jul 3, 2024

• add comput_u func

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• fix imports

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• change function name

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• Merge pull request theochem#127 from RichRick1/PariserParr

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• Fixing problems with tests

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• Merge branch 'PariserParr' of https://github.com/giovanni-br/ModelHamiltonian into PariserParr

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• fixing errors

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Commits on Jul 4, 2024

• rename files

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• fixing a logic in compute_gamma

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Commits on Jul 9, 2024

• adding comments in the data

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Commits on Jul 12, 2024

• Fixes theochem#123 - Adding TJUV

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Commits on Jul 13, 2024

• Fixing errors

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Commits on Jul 15, 2024

• Fixing errors

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• Fixing errors 2

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• theochem#130: Adding tests

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• theochem#130: Adding tests

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• theochem#130: Adding tests

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• theochem#130: Adding tests

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• theochem#130: Adding tests

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Commits on Jul 17, 2024

• theochem#130: Adding tests and fixing problems

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Commits on Jul 18, 2024

• theochem#133 and theochem#130: Fixing symmetry

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Commits on Jul 23, 2024

• theochem#133: Improving documentation

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Commits on Aug 6, 2024

• theochem#135 theochem#136 adding the distance matrix and allowing gamma

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• theochem#135 theochem#136 Fixing errors in test_tjuv.py

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• Merge branch 'PariserParr' of https://github.com/giovanni-br/ModelHamiltonian into PariserParr

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Commits on Aug 8, 2024

• theochem#135 theochem#136: Cleaning the code

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Commits on Aug 14, 2024

• theochem#138: Fixing tutorials

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