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Software for the frontiers of quantum chemistry : An overview of developments in the Q-Chem 5 package
- Authors :
- Epifanovsky, Evgeny
Gilbert, Andrew T. B.
Feng, Xintian
Lee, Joonho
Mao, Yuezhi
Mardirossian, Narbe
Pokhilko, Pavel
White, Alec F.
Coons, Marc P.
Dempwolff, Adrian L.
Gan, Zhengting
Hait, Diptarka
Horn, Paul R.
Jacobson, Leif D.
Kaliman, Ilya
Kussmann, Jörg
Lange, Adrian W.
Lao, Ka Un
Levine, Daniel S.
Liu, Jie
McKenzie, Simon C.
Morrison, Adrian F.
Nanda, Kaushik D.
Plasser, Felix
Rehn, Dirk R.
Vidal, Marta L.
You, Zhi-Qiang
Zhu, Ying
Alam, Bushra
Albrecht, Benjamin J.
Aldossary, Abdulrahman
Alguire, Ethan
Andersen, Josefine H.
Athavale, Vishikh
Barton, Dennis
Begam, Khadiza
Behn, Andrew
Bellonzi, Nicole
Bernard, Yves A.
Berquist, Eric J.
Burton, Hugh G. A.
Carreras, Abel
Carter-Fenk, Kevin
Chakraborty, Romit
Chien, Alan D.
Closser, Kristina D.
Cofer-Shabica, Vale
Dasgupta, Saswata
de Wergifosse, Marc
Deng, Jia
Diedenhofen, Michael
Do, Hainam
Ehlert, Sebastian
Fang, Po-Tung
Fatehi, Shervin
Feng, Qingguo
Friedhoff, Triet
Gayvert, James
Ge, Qinghui
Gidofalvi, Gergely
Goldey, Matthew
Gomes, Joe
González-Espinoza, Cristina E.
Gulania, Sahil
Gunina, Anastasia O.
Hanson-Heine, Magnus W. D.
Harbach, Phillip H. P.
Hauser, Andreas
Herbst, Michael F.
Hernández Vera, Mario
Hodecker, Manuel
Holden, Zachary C.
Houck, Shannon
Huang, Xunkun
Hui, Kerwin
Huynh, Bang C.
Ivanov, Maxim
Jász, Ádám
Ji, Hyunjun
Jiang, Hanjie
Kaduk, Benjamin
Kähler, Sven
Khistyaev, Kirill
Kim, Jaehoon
Kis, Gergely
Klunzinger, Phil
Koczor-Benda, Zsuzsanna
Koh, Joong Hoon
Kosenkov, Dimitri
Koulias, Laura
Kowalczyk, Tim
Krauter, Caroline M.
Kue, Karl
Kunitsa, Alexander
Kus, Thomas
Ladjánszki, István
Landau, Arie
Lawler, Keith V.
Lefrancois, Daniel
Lehtola, Susi
Li, Run R.
Li, Yi-Pei
Liang, Jiashu
Liebenthal, Marcus
Lin, Hung-Hsuan
Lin, You-Sheng
Liu, Fenglai
Liu, Kuan-Yu
Loipersberger, Matthias
Luenser, Arne
Manjanath, Aaditya
Manohar, Prashant
Mansoor, Erum
Manzer, Sam F.
Mao, Shan-Ping
Marenich, Aleksandr V.
Markovich, Thomas
Mason, Stephen
Maurer, Simon A.
McLaughlin, Peter F.
Menger, Maximilian F. S. J.
Mewes, Jan-Michael
Mewes, Stefanie A.
Morgante, Pierpaolo
Mullinax, J. Wayne
Oosterbaan, Katherine J.
Paran, Garrette
Paul, Alexander C.
Paul, Suranjan K.
Pavošević, Fabijan
Pei, Zheng
Prager, Stefan
Proynov, Emil I.
Rák, Ádám
Ramos-Cordoba, Eloy
Rana, Bhaskar
Rask, Alan E.
Rettig, Adam
Richard, Ryan M.
Rob, Fazle
Rossomme, Elliot
Scheele, Tarek
Scheurer, Maximilian
Schneider, Matthias
Sergueev, Nickolai
Sharada, Shaama M.
Skomorowski, Wojciech
Small, David W.
Stein, Christopher J.
Su, Yu-Chuan
Sundstrom, Eric J.
Tao, Zhen
Thirman, Jonathan
Tornai, Gábor J.
Tsuchimochi, Takashi
Tubman, Norm M.
Veccham, Srimukh Prasad
Vydrov, Oleg
Wenzel, Jan
Witte, Jon
Yamada, Atsushi
Yao, Kun
Yeganeh, Sina
Yost, Shane R.
Zech, Alexander
Zhang, Igor Ying
Zhang, Xing
Zhang, Yu
Zuev, Dmitry
Aspuru-Guzik, Alán
Bell, Alexis T.
Besley, Nicholas A.
Bravaya, Ksenia B.
Brooks, Bernard R.
Casanova, David
Chai, Jeng-Da
Coriani, Sonia
Cramer, Christopher J.
Cserey, György
DePrince, A. Eugene
DiStasio, Robert A.
Dreuw, Andreas
Dunietz, Barry D.
Furlani, Thomas R.
Goddard, William A.
Hammes-Schiffer, Sharon
Head-Gordon, Teresa
Hehre, Warren J.
Hsu, Chao-Ping
Jagau, Thomas-C.
Jung, Yousung
Klamt, Andreas
Kong, Jing
Lambrecht, Daniel S.
Liang, WanZhen
Mayhall, Nicholas J.
McCurdy, C. William
Neaton, Jeffrey B.
Ochsenfeld, Christian
Parkhill, John A.
Peverati, Roberto
Rassolov, Vitaly A.
Shao, Yihan
Slipchenko, Lyudmila V.
Stauch, Tim
Steele, Ryan P.
Subotnik, Joseph E.
Thom, Alex J. W.
Tkatchenko, Alexandre
Truhlar, Donald G.
Van Voorhis, Troy
Wesolowski, Tomasz A.
Whaley, K. Birgitta
Woodcock, H. Lee
Zimmerman, Paul M.
Faraji, Shirin
Gill, Peter M. W.
Head-Gordon, Martin
Herbert, John M.
Krylov, Anna I.
- Publisher :
- RWTH Aachen University
-
Abstract
- The journal of chemical physics 155(8), 084801 (2021). doi:10.1063/5.0055522<br />Published by American Institute of Physics, Melville, NY
Details
- Language :
- English
- Database :
- OpenAIRE
- Accession number :
- edsair.doi...........572eadc3234bc78868cf62b7f26f603b