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Update basis set #3

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jacharrym opened this issue May 22, 2023 · 1 comment
Open

Update basis set #3

jacharrym opened this issue May 22, 2023 · 1 comment
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help wanted Extra attention is needed

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@jacharrym
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Request made by Marcio: Some basis sets have changed compared to https://www.basissetexchange.org/
@jacharrym jacharrym added the help wanted Extra attention is needed label May 22, 2023
@fsmoncadaa fsmoncadaa mentioned this issue Jun 9, 2023
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@eiktdmo
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eiktdmo commented Jun 19, 2023

Clone repository
Create branch
Rewrite basis sets inside folder lib/basis with those in https://www.basissetexchange.org/ (in format Dmon2K)
Commit changes
Create pull request

@efposadac efposadac pinned this issue Jun 19, 2023
@eiktdmo eiktdmo mentioned this issue Sep 28, 2023
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@fsmoncadaa fsmoncadaa mentioned this issue Nov 15, 2023
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@rafa-pr rafa-pr mentioned this issue Aug 30, 2024
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