Computational characterization of Cu(I)-catalyzed reactions - geometry optimizations.
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Optimization: inputs and outputs. Computations were performed using Firefly 8.0 (Alex Granovsky http://classic.chem.msu.su/gran/firefly/index.html) Excel table and coordinates in .xyz format are available at dx.doi.org/10.6084/m9.figshare.2073322
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2016-02-05
