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1

Adaptive Finite Element Approximations for Kohn--Sham Models

Chen, Huajie, Dai, Xiaoying, Gong, Xingao, He, Lianhua, Zhou, Aihui

Journal:

Multiscale Modeling and Simulation

Year:

2014

Language:

english

File:

PDF, 2.17 MB

english, 2014

2

Incorporation of well-dispersed sub-5-nm graphitic pencil nanodots into ordered mesoporous frameworks

Kong, Biao, Tang, Jing, Zhang, Yueyu, Jiang, Tao, Gong, Xingao, Peng, Chengxin, Wei, Jing, Yang, Jianping, Wang, Yongcheng, Wang, Xianbiao, Zheng, Gengfeng, Selomulya, Cordelia, Zhao, Dongyuan

Journal:

Nature Chemistry

Year:

2015

Language:

english

File:

PDF, 9.42 MB

english, 2015

3

WO 3 Nanoflakes for Enhanced Photoelectrochemical Conversion

Li, Wenjie, Da, Peimei, Zhang, Yueyu, Wang, Yongcheng, Lin, Xuan, Gong, Xingao, Zheng, Gengfeng

Journal:

Year:

2014

Language:

english

File:

PDF, 588 KB

english, 2014

4

Numerical analysis of finite dimensional approximations of Kohn–Sham models

Huajie Chen,Xingao Gong,Lianhua He,Zhang Yang…

Journal:

Advances in Computational Mathematics

Year:

2013

Language:

english

File:

PDF, 651 KB

english, 2013

5

Molybdenum Disulfide: Kinetic Nature of Grain Boundary Formation in As-Grown MoS 2 Monolayers (Adv. Mater. 27/2015)

Cheng, Jingxin, Jiang, Tao, Ji, Qingqing, Zhang, Yu, Li, Zhiming, Shan, Yuwei, Zhang, Yanfeng, Gong, Xingao, Liu, Weitao, Wu, Shiwei

Journal:

Advanced Materials

Year:

2015

File:

PDF, 1.26 MB

2015

6

Kinetic Nature of Grain Boundary Formation in As-Grown MoS 2 Monolayers

Cheng, Jingxin, Jiang, Tao, Ji, Qingqing, Zhang, Yu, Li, Zhiming, Shan, Yuwei, Zhang, Yanfeng, Gong, Xingao, Liu, Weitao, Wu, Shiwei

Journal:

Advanced Materials

Year:

2015

Language:

english

File:

PDF, 1.19 MB

english, 2015

7

Orbital Delocalization and Enhancement of Magnetic Interactions in Perovskite Oxyhydrides

Liu, Kai, Hou, Yusheng, Gong, Xingao, Xiang, Hongjun

Journal:

Scientific Reports

Year:

2016

Language:

english

File:

PDF, 843 KB

english, 2016

8

Experimental and Theoretical Investigation of the Electronic and Geometrical Structures of the Au32 Cluster

Min Ji, Xiao Gu, Xi Li, Xingao Gong, Jun Li, Lai-Sheng Wang

Journal:

Angewandte Chemie

Year:

2005

Language:

english

File:

PDF, 154 KB

english, 2005

9

Experimental and Theoretical Investigation of the Electronic and Geometrical Structures of the Au32 Cluster

Min Ji, Xiao Gu, Xi Li, Xingao Gong, Jun Li, Lai-Sheng Wang

Journal:

Angewandte Chemie International Edition

Year:

2005

Language:

english

File:

PDF, 155 KB

english, 2005

10

Numerical approximations of a nonlinear eigenvalue problem and applications to a density functional model

Huajie Chen, Xingao Gong, Aihui Zhou

Journal:

Mathematical Methods in the Applied Sciences

Year:

2010

Language:

english

File:

PDF, 620 KB

english, 2010

11

A comparative first-principles study of the adsorption of a carbon atom on copper and nickel surfaces

Tu Hu, Qiming Zhang, Jack C. Wells, Xingao Gong, Zhenyu Zhang

Journal:

Physics Letters A

Year:

2010

Language:

english

File:

PDF, 168 KB

english, 2010

12

Dynamical multiscale simulation of nanoindentation

Guowu Ren, Dier Zhang, Xingao Gong

Journal:

Physics Letters A

Year:

2011

Language:

english

File:

PDF, 496 KB

english, 2011

13

Ab-initiomolecular dynamics simulation on nano-system under external pressure

Min Ji, Deyan Sun, Xingao Gong

Journal:

Science China Mathematics

Year:

2004

Language:

english

File:

PDF, 231 KB

english, 2004

14

Teracluster LSSC-II—Its designing principles and applications in large scale numerical simulations

Linbo Zhang, Shiyi Chen, Xinliang Li, Jianwen Cao, Wensheng Zhang, Xingao Gong

Journal:

Science China Mathematics

Year:

2004

Language:

english

File:

PDF, 300 KB

english, 2004

15

Identifying Optimal Inorganic Nanomaterials for Hybrid Solar Cells

Xiang, Hongjun, Wei, Su-Huai, Gong, Xingao

Journal:

The Journal of Physical Chemistry C

Year:

2009

Language:

english

File:

PDF, 873 KB

english, 2009

16

An Optimized Ultraviolet-A Light Photodetector with Wide-Range Photoresponse Based on ZnS/ZnO Biaxial Nanobelt

Linfeng Hu, Jian Yan, Meiyong Liao, Hongjun Xiang, Xingao Gong, Lide Zhang, Xiaosheng Fang

Journal:

Advanced Materials

Year:

2012

Language:

english

File:

PDF, 700 KB

english, 2012

17

An Optimized Ultraviolet-A Light Photodetector with Wide-Range Photoresponse Based on ZnS/ZnO Biaxial Nanobelt (Adv. Mater. 17/2012)

Linfeng Hu, Jian Yan, Meiyong Liao, Hongjun Xiang, Xingao Gong, Lide Zhang, Xiaosheng Fang

Journal:

Advanced Materials

Year:

2012

File:

PDF, 3.70 MB

2012

18

Ensemble effects on ethylene dehydrogenation on PdAu(001) surfaces investigated with first-principles calculations and nudged-elastic-band simulations

Yuan, Dingwang, Gong, Xingao, Wu, Ruqian

Journal:

Physical Review B

Year:

2007

Language:

english

File:

PDF, 305 KB

english, 2007

19

Strain Induced Quantum Effect in Semiconductors

Wang, Zhentang, Chen, Shiyou, Duan, Xiangmei, Sun, Deyan, Gong, Xingao

Journal:

Journal of the Physical Society of Japan

Year:

2012

Language:

english

File:

PDF, 571 KB

english, 2012

20

Si 3 AlP: A New Promising Material for Solar Cell Absorber

Yang, Ji-Hui, Zhai, Yingteng, Liu, Hengrui, Xiang, Hongjun, Gong, Xingao, Wei, Su-Huai

Journal:

Journal of the American Chemical Society

Year:

2012

Language:

english

File:

PDF, 2.78 MB

english, 2012

21

Predicting Two-Dimensional Boron–Carbon Compounds by the Global Optimization Method

Luo, Xinyu, Yang, Jihui, Liu, Hanyu, Wu, Xiaojun, Wang, Yanchao, Ma, Yanming, Wei, Su-Huai, Gong, Xingao, Xiang, Hongjun

Journal:

Journal of the American Chemical Society

Year:

2011

Language:

english

File:

PDF, 3.58 MB

english, 2011

22

Structures of [Ag 7 (SR) 4 ] − and [Ag 7 (DMSA) 4 ] −

Xiang, Hongjun, Wei, Su-Huai, Gong, Xingao

Journal:

Journal of the American Chemical Society

Year:

2010

Language:

english

File:

PDF, 1.53 MB

english, 2010

23

Proton-Induced Dysfunction Mechanism of Cathodes in an Aqueous Lithium Ion Battery

Shu, Qiang, Chen, Long, Xia, Yongyao, Gong, Xingao, Gu, Xiao

Journal:

The Journal of Physical Chemistry C

Year:

2013

Language:

english

File:

PDF, 848 KB

english, 2013

24

Self-stopping effects of lithium penetration into silicon nanowires

Lang, Li, Dong, Chuanding, Chen, Guohong, Yang, Jihui, Gu, Xiao, Xiang, Hongjun, Wu, Ruqian, Gong, Xingao

Journal:

Year:

2013

Language:

english

File:

PDF, 598 KB

english, 2013

25

Interface Structure Prediction from First-Principles

Zhao, Xin, Shu, Qiang, Nguyen, Manh Cuong, Wang, Yangang, Ji, Min, Xiang, Hongjun, Ho, Kai-Ming, Gong, Xingao, Wang, Cai-Zhuang

Journal:

The Journal of Physical Chemistry C

Year:

2014

Language:

english

File:

PDF, 3.10 MB

english, 2014

26

Solar-Driven Photoelectrochemical Probing of Nanodot/Nanowire/Cell Interface

Tang, Jing, Zhang, Yueyu, Kong, Biao, Wang, Yongcheng, Da, Peimei, Li, Jun, Elzatahry, Ahmed A., Zhao, Dongyuan, Gong, Xingao, Zheng, Gengfeng

Journal:

Year:

2014

Language:

english

File:

PDF, 4.08 MB

english, 2014

27

Valley and band structure engineering of folded MoS2 bilayers

Jiang, Tao, Liu, Hengrui, Huang, Di, Zhang, Shuai, Li, Yingguo, Gong, Xingao, Shen, Yuen-Ron, Liu, Wei-Tao, Wu, Shiwei

Journal:

Nature Nanotechnology

Year:

2014

Language:

english

File:

PDF, 2.91 MB

english, 2014

28

Predicting New TiO 2 Phases with Low Band Gaps by a Multiobjective Global Optimization Approach

Chen, Hou-Zun, Zhang, Yue-Yu, Gong, Xingao, Xiang, Hongjun

Journal:

The Journal of Physical Chemistry C

Year:

2014

Language:

english

File:

PDF, 311 KB

english, 2014

29

Diffusion of Vinyl Bromide through the Crystals of p -Bu t -calix[4]arene

Gu, Xiao, Zhang, Liang, Gong, Xingao, Lau, W. M., Liu, Z. F.

Journal:

Journal of Physical Chemistry B

Year:

2008

Language:

english

File:

PDF, 1.13 MB

english, 2008

30

Prediction of Silicon-Based Layered Structures for Optoelectronic Applications

Luo, Wei, Ma, Yanming, Gong, Xingao, Xiang, Hongjun

Journal:

Journal of the American Chemical Society

Year:

2014

Language:

english

File:

PDF, 467 KB

english, 2014

31

Atomic configurations of Pd atoms in PdAu(111) bimetallic surfaces investigated using the first-principles pseudopotential plane wave approach

Yuan, Dingwang, Gong, Xingao, Wu, Ruqian

Journal:

Physical Review B

Year:

2007

Language:

english

File:

PDF, 372 KB

english, 2007

32

Finite Volume Discretizations for Eigenvalue Problems with Applications to Electronic Structure Calculations

Dai, Xiaoying, Gong, Xingao, Yang, Zhang, Zhang, Dier, Zhou, Aihui

Journal:

Multiscale Modeling and Simulation

Year:

2011

Language:

english

File:

PDF, 2.38 MB

english, 2011

33

Peculiar distribution of Pd on Au nanoclusters: First-principles studies

Yuan, Dingwang, Gong, Xingao, Wu, Ruqian

Journal:

Physical Review B

Year:

2008

Language:

english

File:

PDF, 699 KB

english, 2008

34

Decomposition pathways of methanol on the PtAu(111) bimetallic surface: A first-principles study

Yuan, Dingwang, Gong, Xingao, Wu, Ruqian

Journal:

The Journal of Chemical Physics

Year:

2008

Language:

english

File:

PDF, 706 KB

english, 2008

35

d 0 ferromagnetic surface in HfO 2

Chen, Guohong, Zhang, Qinfang, Gong, Xingao, Yunoki, Seiji

Journal:

Journal of Physics Conference Series

Year:

2012

Language:

english

File:

PDF, 645 KB

english, 2012

36

Branched Artificial Nanofinger Arrays by Mesoporous Interfacial Atomic Rearrangement

Kong, Biao, Tang, Jing, Zhang, Yueyu, Selomulya, Cordelia, Gong, Xingao, Liu, Yang, Zhang, Wei, Yang, Jianping, Wang, Wenshuo, Sun, Xiaotian, Wang, Yufei, Zheng, Gengfeng, Zhao, Dongyuan

Journal:

Journal of the American Chemical Society

Year:

2015

Language:

english

File:

PDF, 1.52 MB

english, 2015

37

Mesoporous Fe 2 O 3 –CdS Heterostructures for Real-Time Photoelectrochemical Dynamic Probing of Cu 2+

Tang, Jing, Li, Jun, Zhang, Yueyu, Kong, Biao, Yiliguma,, Wang, Yang, Quan, Yingzhou, Cheng, Hao, Al-Enizi, Abdullah M., Gong, Xingao, Zheng, Gengfeng

Journal:

Analytical Chemistry

Year:

2015

Language:

english

File:

PDF, 4.17 MB

english, 2015

38

Tremendous Thermal Conductivity Reduction in Anti-Dotted Graphene Nanoribbons

Zhang, Huisheng, Guo, Zhi-Xin, Zhao, Wei, Gong, Xingao, Cao, Juexian

Journal:

Journal of the Physical Society of Japan

Year:

2012

Language:

english

File:

PDF, 2.41 MB

english, 2012

39

Two-dimensional SiS Layers with Promising Electronic and Optoelectronic Properties: Theoretical Prediction

Yang, Jihui, Zhang, YueYu, Yin, Wan-Jian, Gong, Xingao, Yakobson, Boris I., Wei, Su-Huai

Journal:

Year:

2016

Language:

english

File:

PDF, 3.38 MB

english, 2016

40

Photoelectrochemical Conversion from Graphitic C3N4 Quantum Dot Decorated Semiconductor Nanowires

An, Tiance, Tang, Jing, Zhang, YueYu, Quan, Yingzhou, Gong, Xingao, Al-Enizi, Abdullah M., Elzatahry, Ahmed A., Zhang, Lijuan, Zheng, Gengfeng

Journal:

ACS Applied Materials & Interfaces

Year:

2016

Language:

english

File:

PDF, 1.04 MB

english, 2016

41

Achieving High Aqueous Energy Storage via Hydrogen-Generation Passivation

Wang, Yuhang, Cui, Xiaoqi, Zhang, Yueyu, Zhang, Lijuan, Gong, Xingao, Zheng, Gengfeng

Journal:

Advanced Materials

Year:

2016

Language:

english

File:

PDF, 2.01 MB

english, 2016

42

Energy Storage: Achieving High Aqueous Energy Storage via Hydrogen-Generation Passivation (Adv. Mater. 35/2016)

Wang, Yuhang, Cui, Xiaoqi, Zhang, Yueyu, Zhang, Lijuan, Gong, Xingao, Zheng, Gengfeng

Journal:

Advanced Materials

Year:

2016

File:

PDF, 2.37 MB

2016

43

Adaptive Finite Element Approximations for a Class of Nonlinear Eigenvalue Problems in Quantum Physics

Chen, Huajie, Gong, Xingao, He, Lianhua, Zhou, Aihui

Journal:

Advances in Applied Mathematics and Mechanics

Year:

2011

Language:

english

File:

PDF, 527 KB

english, 2011

44

Intrinsic Features of an Ideal Glass

Sun, Deyan, Shang, Cheng, Liu, Zhipan, Gong, Xingao

Journal:

Chinese Physics Letters

Year:

2017

Language:

english

File:

PDF, 691 KB

english, 2017

45

Topological Dirac states beyond π orbitals for silicene on SiC(0001) surface

Li, Ping, Li, Xiao, Zhao, Wei, Chen, Hua, Chen, Ming-Xing, Guo, Zhi-Xin, Feng, Ji, Gong, Xingao, McDonald, Allan

Journal:

Year:

2017

Language:

english

File:

PDF, 3.64 MB

english, 2017

46

Exploring Emerging Photovoltaic Materials Beyond Perovskite: The Case of Skutterudite

Yin, Yuan, Huang, Yang, Wu, Yelong, Chen, Guangde, Yin, Wan-Jian, Wei, Su-Huai, Gong, Xingao

Journal:

Chemistry of Materials

Year:

2017

Language:

english

File:

PDF, 938 KB

english, 2017

47

Interplay of Strain and Magnetism in FeSe Monolayers *

Xie, Yun, Feng, Junsheng, Xiang, Hongjun, Gong, Xingao

Journal:

Chinese Physics Letters

Year:

2019

Language:

english

File:

PDF, 865 KB

english, 2019

48

Interplay of Strain and Magnetism in FeSe Monolayers *

Xie, Yun, Feng, Junsheng, Xiang, Hongjun, Gong, Xingao

Journal:

Chinese Physics Letters

Year:

2019

File:

PDF, 865 KB

2019

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