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Update README.md
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JayTheDog committed Aug 4, 2021
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Expand Up @@ -29,4 +29,4 @@ A more detailed documentation on topics like installation and input settings can
- Collision induced dissociation (CID) calculations are now available. Set *cid* in the `qcxms.in` file.

**The tblite library for xTB calculations**
- The [tblite](https://github.com/awvwgk/tblite) library has been included into the program code. This keeps xTB up-to-date and increases the computational time for calculations done with GFN1- and GFN2-xTB.
- The [tblite](https://github.com/awvwgk/tblite) library has been included into the program code. This keeps xtb up-to-date and decreases the computational time for calculations done with GFN1- and GFN2-xTB when compared to earlier versions.

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