79(top 5%)
papers
7.2K(top 2%)
citations
24(top 10%)
h-index
78(top 2%)
g-index
85
all documents
7.5K
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738
citing journals
105
times ranked

Top Authors (by citations)

#AuthorArticlesCitationsR ARankR CRank
1YIhan Shao85,7451521
2Anna I Krylov35,6765316
2Lyudmila V Slipchenko35,676164
2John M Herbert35,676208
2Ryan P Steele35,67675
2Christian Ochsenfeld35,6763515
2Martin Head-Gordon35,6769425
2Thomas R Furlani35,6761013
2Jörg Kussmann35,67632
2Alexis T Bell35,676645
2Barry D Dunietz35,676214
2Chao-Ping Hsu35,6763313
2Vitaly A Rassolov35,6761713
2Nicholas A Besley35,6762813
2Peter M W Gill35,6762416
2Joseph E Subotnik35,676244
2Yousung Jung35,676495
2Robert A Distasio Jr35,676155
2Henry Lee Woodcock35,6761716
2Troy Van Voorhis35,6763914
22Sergey V Levchenko25,158164
22Shawn T Brown25,158355
22Jing Kong25,15832
22Gregory J O Beran25,158326
22Young Min Rhee25,158258
22C David Sherrill25,1586719
22Rustam Z Khaliullin25,158114
22Edina Rosta25,158394
22Daniel M Chipman25,15872
22Henry F Schaefer25,15813610
22Steven Gwaltney25,1582514
22Anthony D Dutoi25,15854
36Shane R Yost23,07955
36Christopher Cramer23,07912610
36Daniel S Lambrecht23,079158
36John A Parkhill23,079127
36Thomas-C Jagau23,079158
36Andreas W Hauser23,079194
36Shaama Mallikarjun Sharada23,079125
36Roberto Peverati23,079126
36Eric J Berquist23,07942
36Jaehoon Kim23,07962
36Dirk R Rehn23,079114
36Prashant Uday Manohar23,07944
36Nicholas J Mayhall23,079166
36Narbe Mardirossian23,07964
36Xing Zhang23,07943
36Arik Landau23,079125
36Matthew B Goldey23,079109
36David W Small23,07996
36Evgeny Epifanovsky23,0791313
36Ka Un Lao23,07985
36Jeng-Da Chai23,07984
36Ksenia B Bravaya23,079189
36Andreas Klamt23,07962
36Michael Diedenhofen23,07922
36Takashi Tsuchimochi23,07953
36Magnus W D Hanson-Heine23,07992
36Jan Wenzel23,07954
36Paul M Zimmerman23,079488
36Donald G Truhlar23,07918612
36Alán Aspuru Guzik23,07914115
36Igor Ying Zhang23,079155
36David Casanova23,0795410
36Alec F White23,07973
36Shervin Fatehi23,07944
36Eric Jon Sundstrom23,07977
36William Goddard23,07920514
36Aleksandr V Marenich23,07934
36Keith Lawler23,079194
36Tim Kowalczyk23,07995
36Ryan M Richard23,0791111
36Kristina D Closser23,07933
36Xintian Feng23,07977
36William A Goddard23,07913414
36Zhi-Qiang You23,07976
36Yu-Chuan Su23,07911
36Caroline M Krauter23,07964
36Oleg Vydrov23,07911
36Leif D Jacobson23,07944
36Adrian W Lange23,07933
36Dmitry Zuev23,0791010
88Aaron M Lee12,5974715
88Robert J Doerksen12,597481
88Frerich J Keil12,597174
88Andreas Heyden12,597544
88Andrew C Simmonett12,5976712
88Edward F C Byrd12,5973715
88Baron Peters12,597544
95Mark S Gordon12,5618220
95Arieh Warshel12,5615416
95Roi Baer12,561349
95Jun Yang12,561224
95Adèle D Laurent12,561543
95Rollin A King12,5613912
95Yan Zhao12,561725
95Edward G Hohenstein12,5615110
95Bernard R Brooks12,5616816
95Eric Neuscamman12,561252
95Xin Xu12,561715
95Roberto Olivares-Amaya12,561147
95Deborah L Crittenden12,561133
95Leslie Vogt12,561437
95Kai Brandhorst12,561103
95An Ghysels12,561215
95Jing Kong12,56125015
95Debashree Ghosh12,561227
95Mark Gordon12,5615015
95Tamar Stein12,561184
95Florian Häse12,5617610
95Joerg Kussmann12,56111
95Ben Albrecht12,56111
95Ester Livshits12,56152
121Yi Zhao2888111
122Yuezhi Mao658748
123Felix Plasser25533181
124Nicole Bellonzi252134
125Abel Carreras1518166
125Pavel Pokhilko1518108
125Tomasz A Wesolowski15182463
125Susi Lehtola15183114
125Katherine J Oosterbaan151875
125James R Gayvert151822
125Jeffrey B Neaton151817983
125Mario Hernández Vera1518112
125Sebastian Ehlert151814858
125Thomas Markovich151865
125Sahil Gulania151855
125Yu Zhang1518454
125Kevin Carter-Fenk151887
125Daniel S Levine15182311
125Marc P Coons151884
125Jonathan Thirman151886
125Qingguo Feng1518214
125Wojciech Skomorowski1518183
125Kevin J Koh151888
125Josefine H Andersen151855
125Kerwin Hui151822
125Atsushi Yamada1518233
125Alexandre Tkatchenko1518121125
125Yi-Pei Li1518124
125Hugh G A Burton151832
125Ádám Jász151853
125Hanjie Jiang1518137
125Dennis Barton1518112
125Alex J W Thom1518329
125Alan E Rask151833
125Kuan-Yu Liu151866
125Gábor János Tornai151843
125Alan D Chien151863
125Run R Li151854
125Kaushik D Nanda151865
125Alexander A Kunitsa151852
125Matthias Loipersberger15181811
125Fabijan Pavošević1518185
125Sharon Hammes-Schiffer151817417
125Triet S Nguyen151833
125Alexander Zech15181363
125Sonia Coriani151810696
125Romit Chakraborty151893
125Jan-Michael Mewes1518208
125Elliot C Rossomme151894
125Bang Cong Huynh151822
125Andreas Dreuw15186477
125Daniel Lefrancois151864
125Srimukh Prasad Veccham151877
125Maxim V Ivanov1518214
125Shirin Faraji1518274
125Adam Rettig151888
125Stefanie A Mewes15181364
125Eloy Ramos-Cordoba1518186
125Zsuzsanna Benda151882
125Jiashu Liang151888
125Jonathon Witte151855
125K Birgitta Whaley15185315
125Pierpaolo Morgante151872
125Alexander C Paul1518195
125Cristina Elizabeth González-Espinoza151844
125Saswata Dasgupta151873
125Anastasia O Gunina1518334
125Bhaskar Rana151855
125Marcus D Liebenthal151844
125Sven Kähler151832
125Qinghui Ge151866
125Marc de Wergifosse1518143
125Norman M Tubman1518177
125Joonho Lee15183317
125Teresa Head-Gordon15188149
125Michael F Herbst1518107
125Zhen Tao1518125
125Maximilian Scheurer15184315
125Marta L Vidal1518187
125C William Mccurdy1518175
125A Eugene Deprince, Iii15184138
125Adrian L Dempwolff1518127
125Maximilian F S J Menger1518136
125Diptarka Hait15182417
125István Ladjánszki151875
125Kun Yao151874
125Christopher J Stein15184763
125Aaditya Manjanath151873
125Ying Zhu151822
125Tarek Scheele151811
125Peter F Mclaughlin151811
125Manuel Hodecker151894
125D Vale Cofer-Shabica151844
125Tim Stauch1518219
125Jie Liu151841
125J Wayne Mullinax151884
125Garrette Paran151811
125Vishikh Athavale151844
125Gergely Gidofalvi15181010
125Stefan Prager1518104
222Ming-Gang Ju7357718
223Huili8238410
224Can Li2185137173
225Zhigang Shuai312173143
226Hang Zang410255
227Helen Playford11013722
227Xiuli Wang11012863
227Richard I Walton110110472
227Zhaochi Feng11015244
227Shaoqing Jin11011513
232Lei Zhang1892833
233Guanhua Chen4871214
234Bin Ren18497212
235Jin Sun67712
236Qian Peng170115157
236Tian Zhang1701413
236Dong Wang1704369
236Jianzhong Fan1702822
240Qiao Zeng46011
241Junjie Yang35635
242An-An Wu1552916
242Yirong Mo1554363
242Xiao-Sheng Yan1551018
245Yaling Ke24922
246Sebastian Mai13579147
246Qi Ou1351137
246Aurélien De La Lande1352818
249ChuanXiang Ye23411
250Shuanglin Hu1332945
251Jiannian Yao23185193
251Long Wang2311539
251Long Wang231811
251Hongbing Fu23142130
255Jun Dai12454119
255Yuanyuan Zhou12495224
255Zhibo Yang324519
255Xiao Cheng Zeng124259485
255Liang1243954
261Weibin Chu221838
261Qin Wu22125172
261Bin Wang22151170
261Christine M Aikens2212486
261Oleg Prezhdo221115249
266Jing Sun11961120
266Yuling Wu1191413
268Chunyun Tu21814
269ZhiYe Zhu21611
269Wenjian Liu1163585
269Qiang Shi11663109
269Hui Chen11671135
273Bin Zhang21211
274Wei Wu184162
274Wei Zhuang1859108
276Shui-Yang Lien162130
276Zilong Zhang161944