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Top Authors (by citations)
#
Author
Articles
Citations
R ARank
R CRank
1
William Goddard
39
1,205
1
1
2
William A Goddard
22
988
1
1
3
Yousung Jung
2
551
1
1
4
Shane R Yost
1
518
1
1
4
Christopher Cramer
1
518
5
2
4
Nicole Bellonzi
1
518
1
1
4
Daniel S Lambrecht
1
518
3
3
4
Yuezhi Mao
1
518
2
2
4
Abel Carreras
1
518
1
1
4
John A Parkhill
1
518
1
1
4
Pavel Pokhilko
1
518
4
3
4
Tomasz A Wesolowski
1
518
2
2
4
Thomas-C Jagau
1
518
1
1
4
Susi Lehtola
1
518
2
1
4
Katherine J Oosterbaan
1
518
1
1
4
Anna I Krylov
1
518
4
3
4
Andreas W Hauser
1
518
1
1
4
Shaama Mallikarjun Sharada
1
518
3
2
4
James R Gayvert
1
518
1
1
4
Jeffrey B Neaton
1
518
6
3
4
Mario Hernández Vera
1
518
1
1
4
Roberto Peverati
1
518
3
2
4
Sebastian Ehlert
1
518
3
2
4
Thomas Markovich
1
518
1
1
4
Sahil Gulania
1
518
2
2
4
Yu Zhang
1
518
2
2
4
Eric J Berquist
1
518
2
2
4
Kevin Carter-Fenk
1
518
2
2
4
Jaehoon Kim
1
518
1
1
4
Daniel S Levine
1
518
2
2
4
YIhan Shao
1
518
12
2
4
Dirk R Rehn
1
518
2
1
4
Marc P Coons
1
518
1
1
4
Prashant Uday Manohar
1
518
1
1
4
Jonathan Thirman
1
518
1
1
4
Qingguo Feng
1
518
2
1
4
Wojciech Skomorowski
1
518
2
2
4
Kevin J Koh
1
518
2
2
4
Lyudmila V Slipchenko
1
518
3
3
4
Josefine H Andersen
1
518
1
1
4
Kerwin Hui
1
518
1
1
4
Atsushi Yamada
1
518
3
3
4
Alexandre Tkatchenko
1
518
4
3
4
Nicholas J Mayhall
1
518
3
2
4
Yi-Pei Li
1
518
3
1
4
Hugh G A Burton
1
518
3
2
4
Narbe Mardirossian
1
518
1
1
4
John M Herbert
1
518
2
2
4
Ádám Jász
1
518
1
1
4
Xing Zhang
1
518
2
2
4
Arik Landau
1
518
1
1
4
Hanjie Jiang
1
518
2
2
4
Matthew B Goldey
1
518
1
1
4
Dennis Barton
1
518
1
1
4
Alex J W Thom
1
518
1
1
4
Alan E Rask
1
518
2
2
4
Kuan-Yu Liu
1
518
1
1
4
Gábor János Tornai
1
518
1
1
4
Alan D Chien
1
518
1
1
4
Ryan P Steele
1
518
1
1
4
David W Small
1
518
1
1
4
Run R Li
1
518
2
2
4
Evgeny Epifanovsky
1
518
1
1
4
Kaushik D Nanda
1
518
2
2
4
Alexander A Kunitsa
1
518
1
1
4
Matthias Loipersberger
1
518
4
3
4
Fabijan Pavošević
1
518
1
1
4
Sharon Hammes-Schiffer
1
518
4
2
4
Ka Un Lao
1
518
3
3
4
Jeng-Da Chai
1
518
3
2
4
Triet S Nguyen
1
518
1
1
4
Christian Ochsenfeld
1
518
2
2
4
Martin Head-Gordon
1
518
4
3
4
Alexander Zech
1
518
2
2
4
Sonia Coriani
1
518
7
5
4
Romit Chakraborty
1
518
2
2
4
Jan-Michael Mewes
1
518
1
1
4
Thomas R Furlani
1
518
1
1
4
Jörg Kussmann
1
518
1
1
4
Elliot C Rossomme
1
518
2
2
4
Ksenia B Bravaya
1
518
2
2
4
Bang Cong Huynh
1
518
1
1
4
Andreas Klamt
1
518
1
1
4
Michael Diedenhofen
1
518
1
1
4
Alexis T Bell
1
518
4
3
4
Andreas Dreuw
1
518
3
2
4
WanZhen Liang
1
518
3
2
4
Daniel Lefrancois
1
518
1
1
4
Srimukh Prasad Veccham
1
518
2
2
4
Maxim V Ivanov
1
518
3
3
4
Takashi Tsuchimochi
1
518
1
1
4
Shirin Faraji
1
518
1
1
4
Adam Rettig
1
518
2
2
4
Stefanie A Mewes
1
518
1
1
4
Eloy Ramos-Cordoba
1
518
2
1
4
Magnus W D Hanson-Heine
1
518
2
2
4
Zsuzsanna Benda
1
518
1
1
4
Jan Wenzel
1
518
1
1
4
Jiashu Liang
1
518
2
2
4
Barry D Dunietz
1
518
3
3
4
Jonathon Witte
1
518
1
1
4
K Birgitta Whaley
1
518
3
3
4
Chao-Ping Hsu
1
518
3
3
4
Vitaly A Rassolov
1
518
2
2
4
Paul M Zimmerman
1
518
3
2
4
Pierpaolo Morgante
1
518
1
1
4
Alexander C Paul
1
518
2
1
4
Donald G Truhlar
1
518
5
2
4
Cristina Elizabeth González-Espinoza
1
518
1
1
4
Saswata Dasgupta
1
518
2
1
4
Alán Aspuru Guzik
1
518
9
5
4
Anastasia O Gunina
1
518
1
1
4
Igor Ying Zhang
1
518
3
2
4
Bhaskar Rana
1
518
2
2
4
Marcus D Liebenthal
1
518
2
2
4
David Casanova
1
518
4
2
4
Sven Kähler
1
518
1
1
4
Qinghui Ge
1
518
1
1
4
Marc de Wergifosse
1
518
1
1
4
Norman M Tubman
1
518
1
1
4
Joonho Lee
1
518
3
2
4
Alec F White
1
518
1
1
4
Shervin Fatehi
1
518
1
1
4
Eric Jon Sundstrom
1
518
1
1
4
Teresa Head-Gordon
1
518
2
2
4
Aleksandr V Marenich
1
518
1
1
4
Michael F Herbst
1
518
2
2
4
Zhen Tao
1
518
1
1
4
Maximilian Scheurer
1
518
2
2
4
Marta L Vidal
1
518
3
3
4
Felix Plasser
1
518
2
1
4
C William Mccurdy
1
518
2
2
4
Nicholas A Besley
1
518
2
2
4
Peter M W Gill
1
518
1
1
4
A Eugene Deprince, Iii
1
518
2
2
4
Keith Lawler
1
518
6
2
4
Adrian L Dempwolff
1
518
1
1
4
Maximilian F S J Menger
1
518
1
1
4
Diptarka Hait
1
518
2
2
4
Tim Kowalczyk
1
518
2
1
4
István Ladjánszki
1
518
1
1
4
Kun Yao
1
518
1
1
4
Christopher J Stein
1
518
2
2
4
Joseph E Subotnik
1
518
2
2
4
Aaditya Manjanath
1
518
2
2
4
Ying Zhu
1
518
1
1
4
Robert A Distasio Jr
1
518
2
2
4
Henry Lee Woodcock
1
518
2
2
4
Tarek Scheele
1
518
1
1
4
Peter F Mclaughlin
1
518
1
1
4
Manuel Hodecker
1
518
1
1
4
Ryan M Richard
1
518
2
2
4
D Vale Cofer-Shabica
1
518
1
1
4
Troy Van Voorhis
1
518
2
2
4
Tim Stauch
1
518
2
2
4
Jie Liu
1
518
2
2
4
J Wayne Mullinax
1
518
1
1
4
Garrette Paran
1
518
1
1
4
Vishikh Athavale
1
518
2
2
4
Kristina D Closser
1
518
1
1
4
Xintian Feng
1
518
2
2
4
Zhi-Qiang You
1
518
1
1
4
Yu-Chuan Su
1
518
1
1
4
Caroline M Krauter
1
518
1
1
4
Oleg Vydrov
1
518
1
1
4
Gergely Gidofalvi
1
518
1
1
4
Leif D Jacobson
1
518
1
1
4
Stefan Prager
1
518
1
1
4
Adrian W Lange
1
518
1
1
4
Dmitry Zuev
1
518
1
1
175
T Brent Gunnoe
7
255
2
2
176
Sen Zhang
4
239
2
2
176
Chang Liu
4
239
2
2
178
Hua Zhou
3
204
5
7
179
Yifan Ye
2
201
1
1
180
Sooyeon Hwang
2
197
7
8
181
Jin Qian
2
195
1
1
182
Hyeyoung Shin
1
189
2
5
182
Zhiyong Zhang
1
189
2
2
182
Yi-Sheng Liu
1
189
1
1
182
Shuang Li
1
189
2
2
182
Gang Wan
1
189
2
2
188
Tao Cheng
7
172
1
2
188
Tao Cheng
7
172
1
2
190
Hao Yang
5
113
1
2
191
Miao Xie
4
111
1
1
192
Charles B Musgrave Iii
7
72
2
2
193
Soonho Kwon
2
70
1
1
194
Diane A Dickie
6
66
2
3
195
Guodong Li
4
65
1
1
195
Bo Duan
4
65
1
1
197
Qi An
3
57
2
3
198
Ana M Geer
3
50
2
1
198
Christopher Webber
3
50
1
1
200
Sergey I Morozov
2
45
1
1
201
Liyuan Huai
1
43
3
1
202
Francisco Dean Toste
1
41
5
7
202
Guiji Liu
1
41
1
3
202
Guosong Zeng
1
41
1
2
202
Francesca Maria Toma
1
41
1
3
206
Matthias T Agne
1
39
2
3
206
Umut Aydemir
1
39
4
4
206
Leah Borgsmiller
1
39
1
1
206
G. Jeffrey Snyder
1
39
13
18
210
Xiaofan Jia
2
38
2
1
211
Charles Machan
1
35
2
2
211
Peter Jakes
1
35
1
2
211
P Philipp M Schleker
1
35
1
3
211
Robert J Nielsen
1
35
1
2
211
Josef Granwehr
1
35
1
1
216
Xiangfeng Duan
1
33
11
25
216
Soo-Kyung Kim
5
33
1
1
216
Chengzhang Wan
1
33
2
6
216
Changhyeok Choi
1
33
2
3
216
Juhwan Noh
1
33
1
1
216
Geun Ho Gu
1
33
1
1
222
Amirhossein Mafi
4
32
1
1
223
Hai Xiao
1
29
3
8
223
Yalu Chen
1
29
1
1
223
Saber Naserifar
1
29
1
1
226
Sunmoon Yu
1
26
3
3
226
Qi Lu
1
26
4
4
226
Sheena Louisia
1
26
3
3
226
Haochen Zhang
1
26
3
3
226
Mufan Li
1
26
3
3
226
Shouping Chen
1
26
3
3
226
Ben Huang
3
26
1
1
226
Chunsong Li
1
26
2
3
226
Mu-Jeng Cheng
1
26
5
4
226
Peidong Yang
1
26
4
18
226
Bei Zhang
1
26
1
1
226
Chubai Chen
1
26
3
3
226
Piedong Yang
1
26
4
17
226
Stefano Cestellos-Blanco
1
26
3
6
241
Brian Guthrie
3
21
1
1
242
Alessandro Fortunelli
2
18
1
3
243
Stephen B Liggett
2
17
1
1
243
Donghwa Kim
2
17
1
1
245
Pengcheng Zhai
1
16
1
1
245
Qingjie Zhang
1
16
1
1
248
Grayson C Johnson
2
15
2
3
248
Shunyan Gu
3
15
1
1
250
Fahmi Bedoui
2
14
1
1
250
Andres Jaramillo-Botero
2
14
1
1
252
Edoardo Mosconi
1
13
1
13
252
Marcelo A Carignano
1
13
2
2
252
Waldemar Kaiser
1
13
2
2
252
Ali Kachmar
1
13
1
1
252
Filippo De Angelis
1
13
9
22
257
Fabio Negreiros Ribeiro
1
12
1
1
257
Jung-A AWoo
1
12
1
1
257
Nicholas Kim
1
12
1
1
257
Mauro Stener
1
12
1
2
257
Moon Young Yang
2
12
1
1
257
Steven S An
1
12
1
3
257
Alina Tokmakova
1
12
1
1
257
Maliheh
1
12
1
1
257
Lauren K Lujan
1
12
1
1
257
Hannah Strzelinski
1
12
1
1
267
Mehdi Sahihi
1
11
1
1
268
Weihao Zhu
1
9
2
2
269
Sonia Chabbra
1
8
2
2
269
Alexander Schnegg
1
8
4
7
271
Zongtang Fang
1
6
3
5
271
Gregory S Yablonsky
1
6
2
2
271
Rebecca Fushimi
1
6
2
4
271
Keng C Chou
1
6
2
3
271
Frans J Walther
1
6
3
3
271
Yixiao Wang
1
6
1
3
271
Gregory Yablonsky
1
6
1
1
278
Xue-Hai Ju
2
5
2
3
278
Tod A Pascal
1
5
4
10
280
Wenjie Xia
1
4
3
4
280
Brian M Stoltz
1
4
2
3
280
Alexander Q Cusumano
1
4
2
2
280
Trevor D Lohrey
1
4
2
8
280
Ke Zhang
1
4
1
1
285
Jonathan Edward Mueller
1
3
1
1
285
Adri van Duin
1
3
10
35
285
Kamyar Akbari Roshan
1
3
1
1
285
Mahdi Khajeh Talkhoncheh
1
3
2
4
289
Zheng Mei
1
2
2
2
289
Konrad Samwer
1
2
2
5
289
William L Johnson
1
2
1
1
292
Maura Malinska
1
0
2
2
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