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Add FHI-aims to users of s-dftd3 library list#131

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awvwgk merged 2 commits intodftd3:mainfrom
jamesagreen:fhi-aims-doc
Dec 20, 2024
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Add FHI-aims to users of s-dftd3 library list#131
awvwgk merged 2 commits intodftd3:mainfrom
jamesagreen:fhi-aims-doc

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@jamesagreen
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I recently implemented the simple-dftd3 library into FHI-aims (https://fhi-aims.org/), as of version 240920. Therefore I updated the "Users of this library" list in the docs to reflect this.

Signed-off by: James Green <green@ms1p.org>
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Thanks, great to see D3 in FHI-aims.

Some minor suggestions for the reference, otherwise looks good to me.

Comment thread doc/_static/references.bib Outdated
date = {2009},
journal = {Computer Physics Communications},
title = {Ab initio molecular simulations with numeric atom-centered orbitals},
doi = {https://doi.org/10.1016/j.cpc.2009.06.022},
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Suggested change
doi = {https://doi.org/10.1016/j.cpc.2009.06.022},
doi = {10.1016/j.cpc.2009.06.022},

Comment thread doc/_static/references.bib Outdated
doi = {https://doi.org/10.1016/j.cpc.2009.06.022},
number = {11},
pages = {2175-2196},
url = {https://www.sciencedirect.com/science/article/pii/S0010465509002033},
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Suggested change
url = {https://www.sciencedirect.com/science/article/pii/S0010465509002033},
url = {https://doi.org/10.1016/j.cpc.2009.06.022},

Signed-off by: James Green <green@ms1p.org>
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Sure thing, I just updated the reference!

@awvwgk awvwgk merged commit f183094 into dftd3:main Dec 20, 2024
@jamesagreen jamesagreen deleted the fhi-aims-doc branch December 20, 2024 09:34
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2 participants