The Chronus Quantum (ChronusQ) Software Package [v. Beta] - A high-performance computational chemistry software package with a strong emphasis on explicitly time-dependent and post-SCF quantum mechanical methods.

Copyright (C) 2014-2015 Li Research Group (University of Washington)

Please see doc/ChronusQUserManual.pdf for instructions on Installation and Validation of the ChronusQ Software Package

ChronusQ uses the high-performace Libint library [1] for the evaluation of molecular integrals over gaussian type functions. A preconfigured copy (uncompiled) is located in the /deps directory.

For more information about the contributors to ChronusQ, see AUTHORS For more information regarding installation of ChronusQ, see INSTALL For more information regarding the dependencies of ChronusQ, see DEPENDS

[1] Edward F. Valeev; Libint: machine-generated library for efficient evaluation of molecular integrals over Gaussians, version 2.1.0; https://github.com/evaleev/libint/; 2015