2015 | Advances in molecular quantum chemistry contained in the Q-Chem 4 program package | Yihan Shao; Zhengting Gan; Evgeny Epifanovsky; Andrew T.B. Gilbert; Michael Wormit; Joerg Kussmann; Adrian W. Lange; Andrew Behn; Jia Deng; Xintian Feng; Debashree Ghosh; Matthew Goldey; Paul R. Horn; Leif D. Jacobson; Ilya Kaliman; Rustam Z. Khaliullin; Tomasz Kuś; Arie Landau; Jie Liu; Emil I. Proynov; Young Min Rhee; Ryan M. Richard; Mary A. Rohrdanz; Ryan P. Steele; Eric J. Sundstrom; H. Lee Woodcock III; Paul M. Zimmerman; Dmitry Zuev; Ben Albrecht; Ethan Alguire; Brian Austin; Gregory J. O. Beran; Yves A. Bernard; Eric Berquist; Kai Brandhorst; Ksenia B. Bravaya; Shawn T. Brown; David Casanova; Chun-Min Chang; Yunqing Chen; Siu Hung Chien; Kristina D. Closser; Deborah L. Crittenden; Michael Diedenhofen; Robert A. DiStasio Jr.; Hainam Do; Anthony D. Dutoi; Richard G. Edgar; Shervin Fatehi; Laszlo Fusti-Molnar; An Ghysels; Anna Golubeva-Zadorozhnaya; Joseph Gomes; Magnus W.D. Hanson-Heine; Philipp H.P. Harbach; Andreas W. Hauser; Edward G. Hohenstein; Zachary C. Holden; Thomas-C. Jagau; Hyunjun Ji; Benjamin Kaduk; Kirill Khistyaev; Jaehoon Kim; Jihan Kim; Rollin A. King; Phil Klunzinger; Dmytro Kosenkov; Tim Kowalczyk; Caroline M. Krauter; Ka Un Lao; Adèle D. Laurent; Keith V. Lawler; Sergey V. Levchenko; Ching Yeh Lin; Fenglai Liu; Ester Livshits; Rohini C. Lochan; Arne Luenser; Prashant Manohar; Samuel F. Manzer; Shan-Ping Mao; Narbe Mardirossian; Aleksandr V. Marenich; Simon A. Maurer; Nicholas J. Mayhall; Eric Neuscamman; C. Melania Oana; Roberto Olivares-Amaya; Darragh P. O’Neill; John A. Parkhill; Trilisa M. Perrine; Roberto Peverati; Alexander Prociuk; Dirk R. Rehn; Edina Rosta; Nicholas J. Russ; Shaama M. Sharada; Sandeep Sharma; David W. Small; Alexander Sodt; Tamar Stein; David Stück; Yu-Chuan Su; Alex J.W. Thom; Takashi Tsuchimochi; Vitalii Vanovschi; Leslie Vogt; Oleg Vydrov; Tao Wang; Mark A. Watson; Jan Wenzel; Alec White; Christopher F. Williams; Jun Yang; Sina Yeganeh; Shane R. Yost; Zhi-Qiang You; Igor Ying Zhang; Xing Zhang; Yan Zhao; Bernard R. Brooks; Garnet K.L. Chan; Daniel M. Chipman; Christopher J. Cramer; William A. Goddard III; Mark S. Gordon; Warren J. Hehre; Andreas Klamt; Henry F. Schaefer III; Michael W. Schmidt; C. David Sherrill; Donald G. Truhlar; Arieh Warshel; Xin Xu; Alán Aspuru-Guzik; Roi Baer; Alexis T. Bell; Nicholas A. Besley; Jeng-Da Chai; Andreas Dreuw; Barry D. Dunietz; Thomas R. Furlani; Steven R. Gwaltney; Chao-Ping Hsu ; Yousung Jung; Jing Kong; Daniel S. Lambrecht; WanZhen Liang; Christian Ochsenfeld; Vitaly A. Rassolov; Lyudmila V. Slipchenko; Joseph E. Subotnik; Troy Van Voorhis; John M. Herbert; Anna I. Krylov; Peter M.W. Gill; Martin Head-Gordon | MOLECULAR PHYSICS 113(2), 184-215 | | | |
2021 | Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package | Evgeny Epifanovsky; Andrew TB Gilbert; Xintian Feng; Joonho Lee; Yuezhi Mao; Narbe Mardirossian; Pavel Pokhilko; Alec F White; Marc P Coons; Adrian L Dempwolff; Zhengting Gan; Diptarka Hait; Paul R Horn; Leif D Jacobson; Ilya Kaliman; Jörg Kussmann; Adrian W Lange; Ka Un Lao; Daniel S Levine; Jie Liu; Simon C McKenzie; Adrian F Morrison; Kaushik D Nanda; Felix Plasser; Dirk R Rehn; Marta L Vidal; Zhi-Qiang You; Ying Zhu; Bushra Alam; Benjamin J Albrecht; Abdulrahman Aldossary; Ethan Alguire; Josefine H Andersen; Vishikh Athavale; Dennis Barton; Khadiza Begam; Andrew Behn; Nicole Bellonzi; Yves A Bernard; Eric J Berquist; Hugh GA Burton; Abel Carreras; Kevin Carter-Fenk; Romit Chakraborty; Alan D Chien; Kristina D Closser; Vale Cofer-Shabica; Saswata Dasgupta; Marc De Wergifosse; Jia Deng; Michael Diedenhofen; Hainam Do; Sebastian Ehlert; Po-Tung Fang; Shervin Fatehi; Qingguo Feng; Triet Friedhoff; James Gayvert; Qinghui Ge; Gergely Gidofalvi; Matthew Goldey; Joe Gomes; Cristina E González-Espinoza; Sahil Gulania; Anastasia O Gunina; Magnus WD Hanson-Heine; Phillip HP Harbach; Andreas Hauser; Michael F Herbst; Mario Hernández Vera; Manuel Hodecker; Zachary C Holden; Shannon Houck; Xunkun Huang; Kerwin Hui; Bang C Huynh; Maxim Ivanov; Ádám Jász; Hyunjun Ji; Hanjie Jiang; Benjamin Kaduk; Sven Kähler; Kirill Khistyaev; Jaehoon Kim; Gergely Kis; Phil Klunzinger; Zsuzsanna Koczor-Benda; Joong Hoon Koh; Dimitri Kosenkov; Laura Koulias; Tim Kowalczyk; Caroline M Krauter; Karl Kue; Alexander Kunitsa; Thomas Kus; István Ladjánszki; Arie Landau; Keith V Lawler; Daniel Lefrancois; Susi Lehtola; Run R Li; Yi-Pei Li; Jiashu Liang; Marcus Liebenthal; Hung-Hsuan Lin; You-Sheng Lin; Fenglai Liu; Kuan-Yu Liu; Matthias Loipersberger; Arne Luenser; Aaditya Manjanath; Prashant Manohar; Erum Mansoor; Sam F Manzer; Shan-Ping Mao; Aleksandr V Marenich; Thomas Markovich; Stephen Mason; Simon A Maurer; Peter F McLaughlin; Maximilian FSJ Menger; Jan-Michael Mewes; Stefanie A Mewes; Pierpaolo Morgante; J Wayne Mullinax; Katherine J Oosterbaan; Garrette Paran; Alexander C Paul; Suranjan K Paul; Fabijan Pavošević; Zheng Pei; Stefan Prager; Emil I Proynov; Ádám Rák; Eloy Ramos-Cordoba; Bhaskar Rana; Alan E Rask; Adam Rettig; Ryan M Richard; Fazle Rob; Elliot Rossomme; Tarek Scheele; Maximilian Scheurer; Matthias Schneider; Nickolai Sergueev; Shaama M Sharada; Wojciech Skomorowski; David W Small; Christopher J Stein; Yu-Chuan Su; Eric J. Sundstrom; Zhen Tao; Jonathan Thirman; Gábor J. Tornai; Takashi Tsuchimochi; Norm M. Tubman; Srimukh Prasad Veccham; Oleg Vydrov; Jan Wenzel; Jon Witte; Atsushi Yamada; Kun Yao; Sina Yeganeh; Shane R. Yost; Alexander Zech; Igor Ying Zhang; Xing Zhang; Yu Zhang; Dmitry Zuev; Alán Aspuru-Guzik; Alexis T. Bell; Nicholas A. Besley; Ksenia B. Bravaya; Bernard R. Brooks; David Casanova; Jeng-Da Chai; Sonia Coriani; Christopher J. Cramer; György Cserey; A. Eugene DePrince III; Robert A. DiStasio Jr.; Andreas Dreuw; Barry D. Dunietz; Thomas R. Furlani; William A. Goddard III; Sharon Hammes-Schiffer; Teresa Head-Gordon; Warren J. Hehre; Chao-Ping Hsu ; Thomas-C. Jagau; Yousung Jung; Andreas Klamt; Jing Kong; Daniel S. Lambrecht; WanZhen Liang; Nicholas J. Mayhall; C. William McCurdy; Jeffrey B. Neaton; Christian Ochsenfeld; John A. Parkhill; Roberto Peverati; Vitaly A. Rassolov; Yihan Shao; Lyudmila V. Slipchenko; Tim Stauch; Ryan P. Steele; Joseph E. Subotnik; Alex J. W. Thom; Alexandre Tkatchenko; Donald G. Truhlar; Troy Van Voorhis; Tomasz A. Wesolowski; K. Birgitta Whaley; H. Lee Woodcock III; Paul M. Zimmerman; Shirin Faraji; Peter M. W. Gill; Martin Head-Gordon; John M. Herbert; Anna I. Krylov | The Journal of Chemical Physics 155, 084801 | | | |