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@awvwgk awvwgk commented Jan 28, 2026

Closes #66

@awvwgk awvwgk self-assigned this Jan 28, 2026
@awvwgk awvwgk added the enhancement New feature or request label Jan 28, 2026
@awvwgk awvwgk force-pushed the fortran-api branch 4 times, most recently from 65e93e2 to 1832b49 Compare January 28, 2026 13:40
- provide C enums
- add atom and molecule types
- add basis set and shell definitions
- add molecule grid and runtime environment
- add load balancer to C API
- add molecular weights for C API
- add functional class wrapping ExchCXX
- add xc integrator and matrix type
- add references for functionals
- add support for reading and writing from HDF5 in C
@awvwgk awvwgk changed the title [WIP] Add Fortran API Add Fortran API Jan 28, 2026
@awvwgk awvwgk added the Fortran API Related to the Fortran API label Jan 28, 2026
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enhancement New feature or request Fortran API Related to the Fortran API

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Add Fortran/C Bindings

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