Q-chem

By November 14, 2016
Description:

Q-Chem is a comprehensive ab initio quantum chemistry package for accurate predictions of molecular structures, reactivities, and vibrational, electronic and NMR spectra.

Versions:3.2; 4.4 with intel/16.0.3; experimental with 4.4/intel
License:Requires Q-chem developer license.

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