41,527
edits
Modules avx512: Difference between revisions
no edit summary
No edit summary |
No edit summary |
||
| Line 1,867: | Line 1,867: | ||
| align="center" | [https://portal.hdfgroup.org/display/support hdf5-mpi] | | align="center" | [https://portal.hdfgroup.org/display/support hdf5-mpi] | ||
| align="center" | io | | align="center" | io | ||
| align="center" | 1.8.18, 1.10.3, 1.10.6, 1.10.7, 1.12.1 | | align="center" | 1.8.18, 1.10.3, 1.10.6, 1.10.7, 1.12.1, 1.12.2 | ||
| <div class="mw-collapsible mw-collapsed" style="white-space: pre-line;"><br />Description: HDF5 is a data model, library, and file format for storing and managing data. It supports an unlimited variety of datatypes, and is designed for flexible and efficient I/O and for high volume and complex data. Homepage: https://portal.hdfgroup.org/display/support URL: https://portal.hdfgroup.org/display/support Compatible modules: python/3.8, python/3.9, python/3.10 Extensions: cached-property-1.5.2, h5py-3.6.0, numexpr-2.8.4, tables-3.7.0 Keyword:io<br /><br /><br /></div> | | <div class="mw-collapsible mw-collapsed" style="white-space: pre-line;"><br />Description: HDF5 is a data model, library, and file format for storing and managing data. It supports an unlimited variety of datatypes, and is designed for flexible and efficient I/O and for high volume and complex data. Homepage: https://portal.hdfgroup.org/display/support URL: https://portal.hdfgroup.org/display/support Compatible modules: python/3.8, python/3.9, python/3.10 Extensions: cached-property-1.5.2, h5py-3.6.0, numexpr-2.8.4, tables-3.7.0 Keyword:io<br /><br /><br /></div> | ||
|- | |- | ||
| Line 5,188: | Line 5,188: | ||
| align="center" | chem | | align="center" | chem | ||
| align="center" | 6.3.0, 6.3.3, 6.4.0, 6.4.1, 6.5.0, 6.5.1 | | align="center" | 6.3.0, 6.3.3, 6.4.0, 6.4.1, 6.5.0, 6.5.1 | ||
| <div class="mw-collapsible mw-collapsed" style="white-space: pre-line;"><br />Description: xtb - Extended tight-binding semi-empirical quantum mechanics Homepage: https://github.com/grimme-lab/xtb URL: https://github.com/grimme-lab/xtb Compatible modules: python/3.8, python/3.9, python/3.10 Extensions: ase-3.22.1, Pint-0.19.2, pydantic-1.9.1, qcelemental-0.24.0, xtb-6.5. | | <div class="mw-collapsible mw-collapsed" style="white-space: pre-line;"><br />Description: xtb - Extended tight-binding semi-empirical quantum mechanics Homepage: https://github.com/grimme-lab/xtb URL: https://github.com/grimme-lab/xtb Compatible modules: python/3.8, python/3.9, python/3.10 Extensions: ase-3.22.1, Pint-0.19.2, pydantic-1.9.1, qcelemental-0.24.0, xtb-6.5.1 Keyword:chem<br /><br /><br /></div> | ||
|- | |- | ||
| align="center" | [https://github.com/xtensor-stack/xtensor xtensor] | | align="center" | [https://github.com/xtensor-stack/xtensor xtensor] | ||