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bridge libint for oss, now v2.8.0 #22
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Hi! This is the friendly automated conda-forge-linting service. I just wanted to let you know that I linted all conda-recipes in your PR ( |
@conda-forge-admin, please rerender |
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@conda-forge-admin, please rerender |
…nda-forge-pinning 2023.09.04.21.55.58
@conda-forge-admin, please rerender |
…nda-forge-pinning 2023.10.28.13.26.14
@conda-forge-admin, please rerender |
…nda-forge-pinning 2023.12.12.14.02.26
@matt-chan (horton) and @jan-janssen (votca), there's a new Libint out, v2.8.0, that's built here. If you've heard rumors of me changing up L2 with cmake, this isn't that. This is mostly user features, not build features. I've told the build to save artifacts if you want to try it out with your downstream packages. I won't merge before, say, 8am Thursday Eastern time. Please let me know if you want more time to test. Thanks! |
@conda-forge-admin, please rerender |
…nda-forge-pinning 2023.12.14.13.22.08
Checklist
Bumped the build number (if the version is unchanged)0
(if the version changed)conda-smithy
(Use the phrase@conda-forge-admin, please rerender
in a comment in this PR for automated rerendering)From a packaging view, v2.8.0 includes:
The actual scientific virtues of 2.8 can be seen here https://github.com/evaleev/libint/blob/v2.8.x/CHANGES
The particular builds introduced by this recipe contain higher derivative (i.e., gradient and Hessian) integrals and possibly some new types of integrals (e.g., f12). I've tried to make sure nothing was dropped, but if there is any trouble, please open an issue. See the NOTES file for exact generation configurations.
closes #21 closes #24