grimme-lab / mctc-lib

Modular computation tool chain library
https://grimme-lab.github.io/mctc-lib
Apache License 2.0
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Investigate jonquil instead of json-fortran for supporting QCSchema and Chemical JSON #61

Open awvwgk opened 1 year ago

awvwgk commented 1 year ago

The JSON frontend for TOML Fortran (https://github.com/toml-f/jonquil/) allows for easier reporting of errors in a similar style as used my other mctc-lib IO implementations. Also, it natively supports inclusion with meson and cmake.