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mirror of https://github.com/TREX-CoE/trexio.git synced 2024-12-22 12:23:54 +01:00
trexio/src
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templates_front Implement trexio_to_bitfield_list functions in all APIs 2022-07-12 17:21:08 +02:00
templates_hdf5 Implement trexio_has_group templates 2022-07-04 11:22:31 +02:00
templates_text Fix compiler warning during strncpy 2022-07-11 16:36:58 +02:00
.gitignore
CMakeLists.txt
numpy.i
pytrexio.i Implement trexio_to_bitfield_list functions in all APIs 2022-07-12 17:21:08 +02:00
README.org

TREXIO source code documentation



The TREXIO library defines a standard format for storing wave functions, together with an C-compatible API such that it can be easily used in any programming language.

The source code of the library is available at https://github.com/trex-coe/trexio and bug reports should be submitted at https://github.com/trex-coe/trexio/issues.


https://trex-coe.eu/sites/default/files/inline-images/euflag.jpg TREX: Targeting Real Chemical Accuracy at the Exascale project has received funding from the European Unions Horizon 2020 - Research and Innovation program - under grant agreement no. 952165. The content of this document does not represent the opinion of the European Union, and the European Union is not responsible for any use that might be made of such content.