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1

Synthesis of HoneycombâStructured Beryllium Oxide via Graphene Liquid Cells

Wang, Lifen, Liu, Lei, Chen, Ji, Mohsin, Ali, Yum, Jung Hwan, Hudnall, Todd W., Bielawski, Christopher W., Rajh, Tijana, Bai, Xuedong, Gao, Shang-Peng, Gu, Gong

Journal:

Angewandte Chemie International Edition

Year:

2020

File:

PDF, 2.18 MB

2020

2

Synthesis of HoneycombâStructured Beryllium Oxide via Graphene Liquid Cells

Wang, Lifen, Liu, Lei, Chen, Ji, Mohsin, Ali, Yum, Jung Hwan, Hudnall, Todd W., Bielawski, Christopher W., Rajh, Tijana, Bai, Xuedong, Gao, Shang-Peng, Gu, Gong

Journal:

Angewandte Chemie

Year:

2020

File:

PDF, 2.18 MB

2020

3

Identification of polymorphs of sp3 bonded carbon and boron nitride using core-level absorption spectroscopy

Shang-Peng Gao, Jing Zhu, Jun Yuan

Journal:

Chemical Physics Letters

Year:

2004

Language:

english

File:

PDF, 781 KB

english, 2004

4

Ab initio calculation of ELNES/XANES of BeO polymorphs

Journal:

physica status solidi (b)

Year:

2010

Language:

english

File:

PDF, 209 KB

english, 2010

5

ELNES for boron, carbon, and nitrogen K-edges with different chemical environments in layered materials studied by density functional theory

Jingying Lu, Shang-Peng Gao, Jun Yuan

Journal:

Ultramicroscopy

Year:

2012

Language:

english

File:

PDF, 1.70 MB

english, 2012

6

Unoccupied electronic states in CaB6 studied by density functional theory and EELS measurements

Gao, Shang-Peng, Jiang, Jun, Cao, Minghe, Zhu, Jing, Yuan, Jun

Journal:

Physical Review B

Year:

2004

Language:

english

File:

PDF, 110 KB

english, 2004

7

Metal Core Bonding Motifs of Monodisperse Icosahedral Au13 and Larger Au Monolayer-Protected Clusters As Revealed by X-ray Absorption Spectroscopy and Transmission Electron Microscopy

Menard, Laurent D., Xu, Huiping, Gao, Shang-Peng, Twesten, Ray D., Harper, Amanda S., Song, Yang, Wang, Gangli, Douglas, Alicia D., Yang, Judith C., Frenkel, Anatoly I.

Journal:

Journal of Physical Chemistry B

Year:

2006

Language:

english

File:

PDF, 424 KB

english, 2006

8

Cubic, wurtzite, and 4H-BN band structures calculated using GW methods and maximally localized Wannier functions interpolation

Journal:

Computational Materials Science

Year:

2012

Language:

english

File:

PDF, 637 KB

english, 2012

9

Band gap of C3N4 in the GW approximation

Yuan Xu, Shang-Peng Gao

Journal:

International Journal of Hydrogen Energy

Year:

2012

Language:

english

File:

PDF, 1.45 MB

english, 2012

10

Crystal structures and band gap characters of h-BN polytypes predicted by the dispersion corrected DFT and GW method

Journal:

Solid State Communications

Year:

2012

Language:

english

File:

PDF, 620 KB

english, 2012

11

Band structures for Ge3N4 polymorphs studied by DFT-LDA and GWA

Gao, Shang-Peng, Cai, Guanhua, Xu, Yuan

Journal:

Computational Materials Science

Year:

2013

Language:

english

File:

PDF, 474 KB

english, 2013

12

core-level spectroscopy of the first-row elements

Gao, Shang-Peng, Pickard, Chris J., Payne, Mike C., Zhu, Jing, Yuan, Jun

Journal:

Physical Review B

Year:

2008

Language:

english

File:

PDF, 207 KB

english, 2008

13

Theoretical ELNES fingerprints of BC2N polytypes

Lu, Jingying, Gao, Shang-Peng

Journal:

Computational Materials Science

Year:

2013

Language:

english

File:

PDF, 591 KB

english, 2013

14

Sub-Nanometer Au Monolayer-Protected Clusters Exhibiting Molecule-like Electronic Behavior: Quantitative High-Angle Annular Dark-Field Scanning Transmission Electron Microscopy and Electrochemical Characterization of Clusters with Precise Atomic Stoichiometry

Menard, Laurent D., Gao, Shang-Peng, Xu, Huiping, Twesten, Ray D., Harper, Amanda S., Song, Yang, Wang, Gangli, Douglas, Alicia D., Yang, Judith C., Frenkel, Anatoly I., Nuzzo, Ralph G., Murray, Royce

Journal:

Journal of Physical Chemistry B

Year:

2006

Language:

english

File:

PDF, 402 KB

english, 2006

15

Band gaps and dielectric functions of cubic and hexagonal diamond polytypes calculated by many-body perturbation theory

Gao, Shang-Peng

Journal:

physica status solidi (b)

Year:

2015

Language:

english

File:

PDF, 714 KB

english, 2015

16

The Stability, Electronic Structure, and Optical Property of TiO 2 Polymorphs

Zhu, Tong, Gao, Shang-Peng

Journal:

The Journal of Physical Chemistry C

Year:

2014

Language:

english

File:

PDF, 7.21 MB

english, 2014

17

Structure and electronic structure of S-doped graphitic C 3 N 4 investigated by density functional theory

Chen, Gang, Gao, Shang-Peng

Journal:

Chinese Physics B

Year:

2012

Language:

english

File:

PDF, 331 KB

english, 2012

18

Anisotropic spectroscopy of nitrogen K-edge in group-III nitrides

Gao, Shang-Peng, Zhang, Aihua, Zhu, Jing, Yuan, Jun

Journal:

Applied Physics Letters

Year:

2004

Language:

english

File:

PDF, 310 KB

english, 2004

19

Core-level spectroscopy calculation and the plane wave pseudopotential method

Gao, Shang-Peng, Pickard, Chris J, Perlov, Alexander, Milman, Victor

Journal:

Journal of Physics Condensed Matter

Year:

2009

Language:

english

File:

PDF, 1.06 MB

english, 2009

20

Effect of configuration and biaxial strain to electronic structure of half-fluorinated graphene

Yu, Wenzhe, Gao, Shang-Peng

Journal:

Surface Science

Year:

2015

Language:

english

File:

PDF, 2.37 MB

english, 2015

21

First-principles calculation of spectral features, chemical shift and absolute threshold of ELNES and XANES using a plane wave pseudopotential method

Mizoguchi, Teruyasu, Tanaka, Isao, Gao, Shang-Peng, Pickard, Chris J

Journal:

Journal of Physics Condensed Matter

Year:

2009

Language:

english

File:

PDF, 457 KB

english, 2009

22

Tuning the electronic structure of silicene and germanene by biaxial strain and electric field

Yan, Jia-An, Gao, Shang-Peng, Stein, Ryan, Coard, Gregory

Journal:

Physical Review B

Year:

2015

Language:

english

File:

PDF, 1.12 MB

english, 2015

23

Band Gap Characters and Ferromagnetic/Antiferromagnetic Coupling in Group-IV Monolayers Tuned by Chemical Species and Hydrogen Adsorption Configurations

Yu, Wen-Zhe, Yan, Jia-An, Gao, Shang-Peng

Journal:

Nanoscale Research Letters

Year:

2015

Language:

english

File:

PDF, 3.04 MB

english, 2015

24

Bottom-up Approach Design, Band Structure and Lithium Storage Properties of Atomically Thin γ-FeOOH Nanosheets

Song, Yun, Cao, Yu, Wang, Jing, Zhou, Yong-Ning, Fang, Fang, Li, Yuesheng, Gao, Shang-Peng, Gu, Qin-Fen, Hu, Linfeng, Sun, Dalin

Journal:

ACS Applied Materials & Interfaces

Year:

2016

Language:

english

File:

PDF, 1.92 MB

english, 2016

25

Edge preference and band gap characters of MoS2 and WS2 nanoribbons

Xiao, Shao-Long, Yu, Wen-Zhe, Gao, Shang-Peng

Journal:

Surface Science

Year:

2016

Language:

english

File:

PDF, 1.44 MB

english, 2016

26

Insight into the hydrogen evolution reaction of nickel dichalcogenide nanosheets: activities related to non-metal ligands

Ge, Yuancai, Gao, Shang-Peng, Dong, Pei, Baines, Robert, Ajayan, Pulickel M., Ye, Mingxin, Shen, Jianfeng

Journal:

Year:

2017

Language:

english

File:

PDF, 985 KB

english, 2017

27

Large-scale Controlled Synthesis of Porous Two-dimensional Nanosheets for Hydrogen Evolution Reaction through a Chemical Pathway

Cui, Zheng, Chu, Hang, Gao, Shang-Peng, Pei, Yu, Ji, Jin, Ge, Yuancai, Dong, Pei, Ajayan, Pulickel M., shen, jian feng, ye, mingxin

Journal:

Year:

2018

Language:

english

File:

PDF, 1.60 MB

english, 2018

28

Phonon dispersions, band structures, and dielectric functions of BeO and BeS polymorphs

Wang, Ke-Long, Gao, Shang-Peng

Journal:

Journal of Physics and Chemistry of Solids

Year:

2018

Language:

english

File:

PDF, 2.83 MB

english, 2018

29

Layer-Dependent Chemically Induced Phase Transition of Two-Dimensional MoS 2

Sun, Lifei, Yan, Xingxu, Zheng, Jingying, Yu, Hongde, Lu, Zhixing, Gao, Shang-peng, Liu, Lina, Pan, Xiaoqing, Wang, Dong, Wang, Zhiguo, Wang, Peng, Jiao, Liying

Journal:

Year:

2018

Language:

english

File:

PDF, 1.50 MB

english, 2018

30

A general strategy for the functionalization of two-dimensional metal chalcogenides

Shen, Jianfeng, Wang, He, Zhuang, Peiyuan, Zeng, Haotian, Ge, Yuancai, Steven, Craig, Dong, Pei, Gao, Shang-Peng, Ye, Mingxin

Journal:

Year:

2018

Language:

english

File:

PDF, 1.45 MB

english, 2018

31

A honeycomb-like monolayer of HfO2 and the calculation of static dielectric constant eliminating the effect of vacuum spacing

Weng, Junhui, Gao, Shang-Peng

Journal:

Physical Chemistry Chemical Physics

Year:

2018

Language:

english

File:

PDF, 4.22 MB

english, 2018

32

Hierarchical Macro-Mesoporous Polymeric Carbon Nitride Microspheres with Narrow Bandgap for Enhanced Photocatalytic Hydrogen Production

Si, Yinsong, Huang, Taoqing, Li, Qiuju, Huang, Yuting, Gao, Shang-Peng, Chen, Min, Wu, Limin

Journal:

Advanced Materials Interfaces

Year:

2018

Language:

english

File:

PDF, 3.20 MB

english, 2018

33

First-principles study of structural, vibrational, and electronic properties of trigonally bonded II-IV-N2

Tang, Hong Ming, Gao, Shang-Peng

Journal:

Computational Materials Science

Year:

2019

Language:

english

File:

PDF, 3.88 MB

english, 2019

34

Density Functional Theory Study of ZnIn 2 S 4 and CdIn 2 S 4 Polymorphs Using Full‐Potential Linearized Augmented Plane Wave Method and Modified Becke–Johnson Potential

Zhang, Yuan Jue, Tang, Hong Ming, Gao, Shang-Peng

Journal:

physica status solidi (b)

Year:

2019

Language:

english

File:

PDF, 2.59 MB

english, 2019

35

Structures and characteristics of atomically thin ZrO 2 from monolayer to bilayer and two-dimensional ZrO 2 –MoS 2 heterojunction

Weng, Junhui, Gao, Shang-Peng

Journal:

Year:

2019

File:

PDF, 1.31 MB

2019

36

Peculiar bond characters of fivefold coordinated octet compound crystals

Sun, An-An, Gao, Shang-Peng, Gu, Gong

Journal:

Chemical Science

Year:

2020

File:

PDF, 1.53 MB

2020

37

Tunable electronic properties and Schottky barrier in graphene/WSe2 heterostructure under out-of-plane strain and electric field

Zhang, Rui, Hao, Guoqiang, Ye, Xiaojun, Gao, Shang-Peng, Li, Hongbo

Journal:

Physical Chemistry Chemical Physics

Year:

2020

File:

PDF, 2.26 MB

2020

38

Layer-dependent band gaps and dielectric constants of ultrathin fluorite crystals

Weng, Junhui, Gao, Shang-Peng

Journal:

Journal of Physics and Chemistry of Solids

Year:

2021

File:

PDF, 8.70 MB

2021