numgrid
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dftlibs
Numerical integration grid for molecules.
Is there any plan to provide a pypi package for numgrid which is compatible with Python >=3.11?
Hello, I pip installed numgrid in an ARM python 3.9.10 environment without any errors, however I receive the following error when I try to import the module: > import numgrid...
In the readme it is mentioned that > The Becke partitioning step is parallelized using [Rayon](https://github.com/rayon-rs/rayon). In other words, this step should be able to use all available cores on...
Bumps [bumpalo](https://github.com/fitzgen/bumpalo) from 3.4.0 to 3.12.0. Changelog Sourced from bumpalo's changelog. 3.12.0 Released 2023-01-17. Added Added the bumpalo::boxed::Box::bump and bumpalo::collections::String::bump getters to get the underlying Bump that a string or...
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It would be very useful to me for my project if a C++ interface was added back. I don't know how hard this is, but if it can be done...
Bumps [smallvec](https://github.com/servo/rust-smallvec) from 1.6.0 to 1.8.0. Release notes Sourced from smallvec's releases. v1.8.0 Add optional support for the arbitrary crate (#275). v1.7.0 new_const and from_const constructors for creating a SmallVec...
Bumps [hyper](https://github.com/hyperium/hyper) from 0.13.9 to 0.13.10. Release notes Sourced from hyper's releases. v0.13.10 Bug Fixes http1: fix server misinterpretting multiple Transfer-Encoding headers (6d9e5f9f) See https://github.com/hyperium/hyper/security/advisories/GHSA-6hfq-h8hq-87mf Changelog Sourced from hyper's changelog....
Bumps [crossbeam-utils](https://github.com/crossbeam-rs/crossbeam) from 0.8.1 to 0.8.8. Release notes Sourced from crossbeam-utils's releases. crossbeam-utils 0.8.8 Fix a bug when unstable loom support is enabled. (#787) crossbeam-utils 0.8.7 Add AtomicCell<{i*,u*}>::{fetch_max,fetch_min}. (#785) Add...
Bumps [crossbeam-deque](https://github.com/crossbeam-rs/crossbeam) from 0.8.0 to 0.8.1. Release notes Sourced from crossbeam-deque's releases. crossbeam-deque 0.8.1 Fix deque steal race condition. (https://github.com/crossbeam-rs/crossbeam/security/advisories/GHSA-pqqp-xmhj-wgcw) Add Stealer::len method. (#708) Changelog Sourced from crossbeam-deque's changelog. Version...
