Journal of Chemical Theory and Computation

5.3(top 5%)

impact factor

9.0K(top 2%)

papers

410.1K(top 1%)

citations

229(top 1%)

h-index

5.4(top 5%)

extended IF

9.5K

all documents

441.0K

doc citations

425(top 1%)

g-index

Top Authors (by article citations)

#	Author	Articles	Citations	R ARank	R CRank
1	Sebastian Ehlert	2	2,255	5	1
1	Stefan Grimme	2	2,255	6	1
1	Christoph Bannwarth	1	1,704	1	1
4	Edward D Harder	1	698	1	1
4	Richard A Friesner	3	797	1	1
4	Chuanjie Wu	1	698	1	1
4	Katarina Roos	1	698	1	1
4	Lingle Wang	2	734	1	1
4	James M Stevenson	1	698	1	1
4	Markus K Dahlgren	1	698	1	1
4	Wolfgang Damm	1	698	1	1
4	Chao Lu	1	698	1	1
13	Liviu Ungur	1	661	1	1
13	Leticia Gonzalez	4	755	2	1
13	Laura Gagliardi	5	761	2	1
13	Sebastian Mai	4	755	1	1
13	Oskar Weser	1	661	1	1
13	Nike Dattani	1	661	1	1
13	Tomasz A Wesolowski	1	661	1	1
13	Gilbert Grell	1	661	1	1
13	Markus Oppel	1	661	1	1
13	Roland H Lindh	2	681	1	1
13	Sijia S Dong	3	692	1	1
13	Quan Manh Phung	4	775	1	1
13	Igor Schapiro	1	661	1	1
13	Jochen Autschbach	3	715	1	1
13	Morgane Vacher	1	661	1	1
13	Stefan Knecht	2	678	1	1
13	Mickaël G Delcey	1	661	1	1
13	Valera Veryazov	1	661	1	1
13	Ali Alavi	2	712	2	1
13	Ignacio Fdez Galván	1	661	1	1
13	Alessio Valentini	1	661	1	1
13	Marcus Lundberg	2	681	1	1
13	Rebecca K Carlson	1	661	1	1
13	Prachi Sharma	1	661	2	1
13	Frédéric Gendron	2	698	1	1
13	Lasse K Sørensen	2	681	1	1
13	Goran Kovacevic	1	661	1	1
13	Kristine Pierloot	4	764	1	1
13	Giovanni Li Manni	2	712	1	1
13	Alexander Zech	1	661	1	1
13	Nikolay A Bogdanov	1	661	1	1
13	Andreas Dreuw	3	710	2	1
13	Stefanie A Mewes	1	661	1	1
13	Andrew M Sand	1	661	1	1
13	Donald G Truhlar	6	757	1	1
13	Mihkel Ugandi	1	661	1	1
13	Massimo Olivucci	4	737	1	1
13	Leon Freitag	2	678	1	1
13	Philipp Marquetand	1	661	1	1
13	Angelo Giussani	1	661	2	1
13	Markus Reiher	5	819	1	1
13	J Patrick Zobel	1	661	1	1
13	Per-Åke Malmqvist	1	661	1	1
13	Jie J Bao	2	688	1	1
13	Felix Plasser	3	741	1	1
13	Sergey I Bokarev	1	661	1	1
13	Luis Manuel Frutos Gaite	1	661	1	1
13	Jesper Norell	1	661	1	1
13	Celestino Angeli	1	661	1	1
13	Liviu F Chibotaru	1	661	1	1
13	Marcus Johansson	1	661	1	1
13	Christopher J Stein	1	661	2	1
13	Meiyuan Guo	2	681	1	1
13	Chad E Hoyer	1	661	1	1
13	Francesco Aquilante	1	661	1	1
13	Joel Creutzberg	1	661	1	1
13	Sebastian Wouters	1	661	1	1
13	Steven Vancoillie	1	661	1	1
73	Oliver T Unke	1	501	2	1
73	Markus Meuwly	1	501	4	1
75	Wonpil Im	4	423	1	1
75	Jonas Ståhle	1	388	2	1
75	Miguel Ángel Valvano	1	388	1	1
75	Göran Widmalm	1	388	2	1
75	Jeffery B Klauda	2	421	2	1
75	Seonghoon Kim	1	388	1	1
75	Jumin Lee	1	388	1	1
75	Yifei Qi	2	405	4	2
75	Sang-Jun Park	1	388	1	1
84	Martin Head-Gordon	5	397	2	1
84	K Birgitta Whaley	2	302	1	1
84	Joonho Lee	1	260	2	1
84	William Huggins	1	260	1	1
84	William J Huggins	1	260	1	1
89	Michael Gastegger	1	240	1	2
89	Kristof Schütt	1	240	1	2
89	Alexandre Tkatchenko	2	253	2	3
89	Klaus-Robert Müller	1	240	6	3
93	Christoph Dellago	3	303	1	1
93	Jörg Behler	3	371	1	1
93	Andreas Singraber	2	299	1	1
96	Manuel N Melo	1	159	1	1
96	Siewert-Jan Marrink	1	159	3	2
96	Sebastian Thallmair	1	159	1	1
96	Alex H De Vries	1	159	1	1
96	Paulo Ct Souza	1	159	1	2
96	Riccardo Alessandri	1	159	1	1
102	Robert Izsak	2	179	1	1
102	Frank Neese	5	385	1	1
111	Sonia Coriani	4	257	2	1
119	Denis Jacquemin	4	221	2	1
119	Pierre-Francois Loos	5	323	1	1
119	Michel Caffarel	2	224	1	1
123	Péter R Nagy	2	130	1	1
123	Mihaly Kallay	6	179	1	1
125	Sergio Pantano	2	145	1	1
125	Exequiel E Barrera	2	145	1	1
125	Matías Rodrigo Machado	2	145	1	1
125	Matias R Machado	2	145	1	1
130	Anthony Scemama	2	142	1	1
151	Philippe Derreumaux	2	129	2	2
151	Junmei Wang	2	128	1	2
151	Michele Ceriotti	3	155	2	7
162	Jiřı́ Šponer	4	208	1	1
162	Giovanni Bussi	2	151	1	1
162	Pavel Banáš	3	206	1	1
162	Miroslav Krepl	2	99	1	1
170	Chia-En A Chang	2	161	1	1
173	Yongqiang Cheng	2	104	1	3
173	Anibal J Ramirez-Cuesta	2	104	2	4
177	Jean-Philip Piquemal	3	118	1	3
177	Pengyu Ren	2	106	1	2
181	Ahmet Altun	3	206	1	1
181	Giovanni Bistoni	3	206	1	1
190	Bun Chan	3	134	1	1
190	Yi Wang	2	112	1	1
190	Alexey V Onufriev	2	116	1	2
190	Saeed Izadi	2	116	1	1
208	Christine Peter	2	82	1	1
211	Daniele Ongari	2	100	1	1
211	Berend Smit	4	129	1	5
223	Gerhard Hummer	2	85	3	5
223	Jürgen Köfinger	2	85	1	1
227	Alberto Baiardi	2	83	1	1
227	Stefan Vuckovic	2	73	1	1
241	Yuji Sugita	3	108	2	1
243	James Shee	3	138	1	2
243	David A Egger	2	99	2	4
243	Shiwei Zhang	4	150	1	1
243	David R Reichman	2	99	1	1
251	Fabijan Pavošević	2	71	2	2
251	Sharon Hammes-Schiffer	3	104	4	3
251	Tanner Culpitt	2	71	1	1
258	Alexander D Mackerell	3	99	1	2
258	Frank Jensen	3	89	1	1
264	Chiara Cappelli	3	114	1	1
264	Matteo Ambrosetti	3	114	1	1
264	Tommaso Giovannini	3	114	1	1
264	Marie Skepö	2	70	1	1
280	Lan Cheng	2	104	2	1
296	Michele Parrinello	7	199	1	1
296	Dan Mendels	5	137	1	1
296	Paolo Carloni	4	132	1	1
305	Julian Tirado-Rives	2	67	1	1
305	Milica Feldt	2	82	1	1
305	Boyi Zhang	2	60	1	1
305	Jeremy Harvey	2	82	2	2
305	David P Tew	3	74	1	1
305	William L Jorgensen	2	67	1	1
305	Daniel Kats	3	77	1	1
305	Doaa Altarawy	2	60	1	2
305	Henry F Schaefer	2	60	5	2
305	Justin M Turney	2	60	2	1
319	Jochen Hub	2	86	1	1
319	Mario Barbatti	2	58	1	1
319	Rachel Crespo-Otero	2	79	1	2
329	Nicholas J Mayhall	3	83	1	2
329	Daniel Claudino	2	76	1	1
329	Teresa Head-Gordon	2	61	1	3
341	Rohit V Pappu	2	59	1	6
341	Lan Nguyen Tran	2	78	1	1
341	Jeong-Mo Choi	2	59	1	2
341	Dominika Zgid	2	81	1	1
364	Rochus Schmid	2	46	1	2
364	Peter G Bolhuis	2	79	1	2
364	Andrea Cavalli	2	77	1	2
364	Rommie E Amaro	2	65	2	3
364	John D Chodera	4	130	1	1
364	Frank Noé	2	79	2	6
364	Jan-Hendrik Prinz	2	79	1	1
384	María del Carmen Marín Pérez	2	60	1	1
384	Z Faidon Brotzakis	2	62	1	1
384	Hannes Jónsson	4	86	1	2
384	Luca De Vico	2	60	1	1
384	Vittorio Limongelli	2	86	1	2
384	Jonny Proppe	2	75	1	1
395	Oliviero Andreussi	2	50	1	3
395	Ray Luo	3	79	1	1
395	Nicola Marzari	4	95	1	6
395	Francesco Nattino	2	50	1	3
415	Anna S Kamenik	2	52	1	1
415	Klaus R. Liedl	2	52	1	2
429	Karsten Reuter	2	47	3	6
429	Harald Oberhofer	2	47	2	2
429	Jeffrey Comer	2	68	1	1
446	Xiaosong Li	7	187	1	1
446	Rasmus Faber	2	64	1	1
446	A Eugene Deprince, Iii	4	108	1	1
446	David B Williams-Young	5	136	1	1
460	Garnet Chan	2	54	3	4
460	Filippo Lipparini	5	103	1	1
460	Peter V Coveney	2	67	2	3
460	Alec F White	2	54	1	1
474	Fionn D Malone	2	71	1	1
482	Alessandro Erba	2	73	2	1
482	Eduardo Fabiano	2	63	1	1
482	Lorenzo Maschio	2	73	1	1
482	Michel Rérat	2	73	1	1
482	Roberto Dovesi	2	73	1	1
482	Philippe Carbonniere	2	73	1	1
482	Fabio Della Sala	2	63	1	1
482	Jefferson Maul	2	73	1	1
482	Matteo Ferrabone	2	73	1	1
504	Andre Laestadius	2	50	1	1
504	Simen Kvaal	2	50	1	2
504	Jiří Pittner	2	49	1	1
530	Hans-Joachim Werner	3	63	1	2
530	Dmitri G Fedorov	3	73	1	1
537	Krishnan Raghavachari	4	73	1	1
537	Troy Van Voorhis	4	86	1	2
558	Wei Jiang	2	40	1	2
558	Charles J C Scott	3	63	1	1
558	Nick Blunt	3	73	1	1
558	Alex J W Thom	6	108	1	1
558	Michael Gilson	3	84	1	2
558	Verena A Neufeld	2	57	1	1
558	Roberto Di Remigio	2	57	1	1
558	James J Shepherd	2	46	1	1
558	Shichao Sun	3	79	1	1
558	Christophe Chipot	4	83	1	3
558	Maria-Andreea Filip	2	43	1	1
558	Michael K Gilson	3	84	1	1
610	Emiliano Ippoliti	2	63	1	1
610	Jógvan Magnus Haugaard Olsen	3	83	1	1
610	Ursula Röthlisberger	4	88	1	2
610	Simone Meloni	2	63	1	2
610	Jianhan Chen	2	60	1	2
610	Martin Peter Bircher	3	69	1	1
610	Viacheslav Bolnykh	2	63	1	1
640	Eric Neuscamman	3	55	1	1
640	Venkat Kapil	2	53	1	4
640	Bishnu Thapa	3	39	1	1
661	Toru Shiozaki	2	37	1	1
661	David L Mobley	4	80	1	2
661	Jae Woo Park	3	69	1	1
661	Chigusa Kobayashi	2	44	1	2
683	Katharina Boguslawski	2	44	1	1
683	Erik I Tellgren	2	43	1	1
694	Hongbin Liu	2	44	1	4
694	Andrew J Jenkins	2	44	1	1
694	Hossein Eslami	2	53	1	1
694	Michael Lesiuk	2	53	1	2
694	Philippe H Hünenberger	2	45	1	1
694	Florian Müller-Plathe	2	53	1	1
720	Mohammad Mostafanejad	2	51	1	1
720	Richard W Pastor	3	59	1	4
720	Adam W Duster	2	45	1	1
720	Hai Lin	2	45	2	1
720	J Wayne Mullinax	2	44	1	1
720	Gergely Gidofalvi	2	44	1	1
739	Mark S Gordon	2	36	2	2
739	Thomas Dannenhoffer-Lafage	2	48	1	1
739	Gregory A Voth	2	48	4	5
739	Francesco Paesani	3	64	1	4
739	Buu Q Pham	2	36	1	1
763	Hong-Zhou Ye	2	47	1	3
763	Shaul Mukamel	2	30	3	4
763	Nicola Colonna	2	45	1	1
763	Michał Przybytek	3	53	1	1
803	Alberto Striolo	2	45	1	1
803	Andrew Wildman	2	40	1	1
803	Xiao He	2	41	1	2
803	Benedetta Mennucci	3	53	1	4
803	Giovanni Scalmani	2	35	1	2
833	Vicenzo Barone	2	40	3	5
833	Jochen Blumberger	2	29	1	3
858	Teresa E Reinhard	2	36	1	1
858	Pier Paolo Poier	2	31	1	1
858	Ángel Rubio Secades	2	36	2	11
858	Angel Rubio	2	36	1	9
884	David Mester	3	49	1	1
884	Filipp Furche	2	39	1	2
884	Timothy C Berkelbach	2	39	1	4
884	Markus Fleck	2	29	1	1
884	Shunyang Wang	2	26	1	2
884	Alexander D Mackerell Jr	2	41	1	2
933	Raffaello Potestio	2	36	2	1
933	David J Wales	3	38	2	4
933	Louis Lagardère	2	29	1	2
973	Shu-Hua Li	3	44	1	5
973	Nico F A Van Der Vegt	2	26	1	5
973	Peter Pulay	2	30	1	1
1009	Laurens D M Peters	2	25	1	1
1009	Mayank Dodia	2	30	1	2
1009	Tatsuhiko Ohto	2	30	2	4
1009	Yuki Nagata	2	30	1	4
1009	Michele Invernizzi	2	34	1	2
1009	Christian Ochsenfeld	4	53	1	4
1009	Jiří Vondrášek	2	26	1	3
1055	Hiromi Nakai	2	30	3	6
1055	Diogo Vila-Viçosa	2	32	1	2
1055	Michał Hapka	2	28	1	1
1055	Katarzyna Pernal	3	40	1	1
1160	Srinivasan S Iyengar	2	25	2	1
1160	Hugh G A Burton	2	21	1	1
1194	Wei Li	2	25	1	2
1194	Zhigang Ni	2	25	1	1
1271	Nobuyuki Matubayasi	2	21	2	5
1271	Ryuhei Harada	2	24	1	1
1271	Yasuteru Shigeta	2	24	4	3
1271	Soohyung Park	2	19	1	1
1271	Adrian E Roitberg	2	15	1	3
1331	Elvar Jónsson	2	19	1	1
1331	Asmus Ougaard Dohn	2	19	1	3
1331	Pal D Mezei	2	18	1	1
1367	Stefano Corni	2	18	1	7
1367	Eli Pollak	2	18	1	1
1405	Christian Waibel	2	11	1	1
1405	Joachim Groß	3	15	1	3
1439	Rosendo Valero	2	10	1	1
1499	Sameer Jadhav	2	8	1	2
1499	Rakesh Vaiwala	2	8	1	1
1499	Rochish M Thaokar	2	8	2	6

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