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Updated QMMM_MQAE README to include paper reference

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Arno Proeme 2020-06-18 21:35:33 +01:00 • committed by Ole Schütt
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benchmarks/QMMM_MQAE/README.md
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@ -13,6 +13,8 @@ The QM/MM coupling is described with the Gaussian Expansion of the Electrostatic
Potential (GEEP) method, and the bonds between theQM and MM atoms are treated
using the Generalized Hybrid Orbital (GHO) method.
See also https://doi.org/10.1021/acs.jctc.9b00424
## Files description
``MQAE.inp`` - CP2K input file.