@article{ReithKirschner2011, author = {Dirk Reith and Karl N. Kirschner}, title = {A modern workflow for force-field development – Bridging quantum mechanics and atomistic computational models}, series = {Computer Physics Communications}, volume = {182}, number = {10}, publisher = {Elsevier}, issn = {0010-4655}, doi = {10.1016/j.cpc.2011.05.018}, pages = {2184 -- 2191}, year = {2011}, language = {en} }