@article{doi:10.1063/5.0059356, author = {Smith,Daniel G. A. and Lolinco,Annabelle T. and Glick,Zachary L. and Lee,Jiyoung and Alenaizan,Asem and Barnes,Taylor A. and Borca,Carlos H. and Di Remigio,Roberto and Dotson,David L. and Ehlert,Sebastian and Heide,Alexander G. and Herbst,Michael F. and Hermann,Jan and Hicks,Colton B. and Horton,Joshua T. and Hurtado,Adrian G. and Kraus,Peter and Kruse,Holger and Lee,Sebastian J. R. and Misiewicz,Jonathon P. and Naden,Levi N. and Ramezanghorbani,Farhad and Scheurer,Maximilian and Schriber,Jeffrey B. and Simmonett,Andrew C. and Steinmetzer,Johannes and Wagner,Jeffrey R. and Ward,Logan and Welborn,Matthew and Altarawy,Doaa and Anwar,Jamshed and Chodera,John D. and Dreuw,Andreas and Kulik,Heather J. and Liu,Fang and Martínez,Todd J. and Matthews,Devin A. and Schaefer,Henry F. and Šponer,Jiří and Turney,Justin M. and Wang,Lee-Ping and De Silva,Nuwan and King,Rollin A. and Stanton,John F. and Gordon,Mark S. and Windus,Theresa L. and Sherrill,C. David and Burns,Lori A. }, title = {Quantum Chemistry Common Driver and Databases (QCDB) and Quantum Chemistry Engine (QCEngine): Automation and interoperability among computational chemistry programs}, journal = {The Journal of Chemical Physics}, volume = {155}, number = {20}, pages = {204801}, year = {2021}, doi = {10.1063/5.0059356}, URL = { https://doi.org/10.1063/5.0059356 }, eprint = { https://doi.org/10.1063/5.0059356 } }