Xiao, Penghao: search on Z-Library

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1

A generalized solid-state nudged elastic band method

Sheppard, Daniel, Xiao, Penghao, Chemelewski, William, Johnson, Duane D., Henkelman, Graeme

Journal:

The Journal of Chemical Physics

Year:

2012

Language:

english

File:

PDF, 3.38 MB

english, 2012

2

Theoretical and Experimental Study of Vanadium-Based Fluorophosphate Cathodes for Rechargeable Batteries

Xu, Maowen, Xiao, Penghao, Stauffer, Shannon, Song, Jie, Henkelman, Graeme, Goodenough, John B.

Journal:

Chemistry of Materials

Year:

2014

Language:

english

File:

PDF, 6.95 MB

english, 2014

3

Kinetic Monte Carlo Study of Li Intercalation in LiFePO4

Xiao, Penghao, Henkelman, Graeme

Journal:

Year:

2017

Language:

english

File:

PDF, 1.32 MB

english, 2017

4

Removal of Interstitial H 2 O in Hexacyanometallates for a Superior Cathode of a Sodium-Ion Battery

Song, Jie, Wang, Long, Lu, Yuhao, Liu, Jue, Guo, Bingkun, Xiao, Penghao, Lee, Jong-Jan, Yang, Xiao-Qing, Henkelman, Graeme, Goodenough, John B.

Journal:

Journal of the American Chemical Society

Year:

2015

Language:

english

File:

PDF, 3.85 MB

english, 2015

5

Theoretical Study of the Structural Evolution of a Na 2 FeMn(CN) 6 Cathode upon Na Intercalation

Xiao, Penghao, Song, Jie, Wang, Long, Goodenough, John B., Henkelman, Graeme

Journal:

Chemistry of Materials

Year:

2015

Language:

english

File:

PDF, 3.41 MB

english, 2015

6

[IEEE 2019 IEEE 10th International Conference on Mechanical and Intelligent Manufacturing Technologies (ICMIMT) - Cape Town, South Africa (2019.2.15-2019.2.17)] 2019 IEEE 10th International Conference on Mechanical and Intelligent Manufacturing Technologies (ICMIMT) - Error Estimation of Titanium Alloy Thin-walled Parts Based on Stiffness Model

Long, Wu, Aimin, Wang, Penghao, Ren, Shihong, Xiao, Yue, Ding

Year:

2019

Language:

english

File:

PDF, 3.11 MB

english, 2019

7

Surface integrity and tool wear mechanism of 7050-T7451 aluminum alloy under dry cutting

Ping, Zhang, Xiujie, Yue, Penghao, Wang, Xiao, Yu

Journal:

Year:

2020

File:

PDF, 14.13 MB

2020

8

Additional Sodium Insertion into Polyanionic Cathodes for Higher-Energy Na-Ion Batteries

Bianchini, Matteo, Xiao, Penghao, Wang, Yan, Ceder, Gerbrand

Journal:

Advanced Energy Materials

Year:

2017

Language:

english

File:

PDF, 2.27 MB

english, 2017

9

Fabrication and In Vitro Study of Tissue-Engineered Cartilage Scaffold Derived from Wharton’s Jelly Extracellular Matrix

Xiao, Tongguang, Guo, Weimin, Chen, Mingxue, Hao, Chunxiang, Gao, Shuang, Huang, Jingxiang, Yuan, Zhiguo, Zhang, Yu, Wang, Mingjie, Li, Penghao, Peng, Jiang, Wang, Aiyuan, Wang, Yu, Sui, Xiang, Zhang,

Journal:

BioMed Research International

Year:

2017

Language:

english

File:

PDF, 3.64 MB

english, 2017

10

Calculations of Oxygen Adsorption-Induced Surface Reconstruction and Oxide Formation on Cu(100)

Lian, Xin, Xiao, Penghao, Liu, Renlong, Henkelman, Graeme

Journal:

Chemistry of Materials

Year:

2017

Language:

english

File:

PDF, 3.52 MB

english, 2017

11

Fast Mg 2+ diffusion in Mo 3 (PO 4 ) 3 O for Mg batteries

Rong, Ziqin, Xiao, Penghao, Liu, Miao, Huang, Wenxuan, Hannah, Daniel C., Scullin, William, Persson, Kristin A., Ceder, Gerbrand

Journal:

Chemical Communications

Year:

2017

Language:

english

File:

PDF, 1.11 MB

english, 2017

12

Benchmarks for Characterization of Minima, Transition States, and Pathways in Atomic, Molecular, and Condensed Matter Systems

Chill, Samuel T., Stevenson, Jacob, Ruehle, Victor, Shang, Cheng, Xiao, Penghao, Farrell, James D., Wales, David J., Henkelman, Graeme

Journal:

Journal of Chemical Theory and Computation

Year:

2014

Language:

english

File:

PDF, 364 KB

english, 2014

13

A Highly Efficient Double-Hierarchical Sulfur Host for Advanced Lithium-Sulfur Batteries

Hu, Linyu, Dai, Chunlong, Lim, Jin-Myoung, Chen, Yuming, Lian, Xin, Wang, Min-Qiang, Li, Yi, Xiao, Penghao, Henkelman, Graeme, Xu, Mao-Wen

Journal:

Chemical Science

Year:

2017

Language:

english

File:

PDF, 2.89 MB

english, 2017

14

Shear-Assisted Formation of Cation-Disordered Rocksalt NaMO2 (M = Fe, Mn)

Shi, Tan, Xiao, Penghao, Kwon, Deok-Hwang, Sai Gautam, Gopalakrishnan, Chakarawet, Khetpakorn, Kim, Hyunchul, Bo, Shou-Hang, Ceder, Gerbrand

Journal:

Chemistry of Materials

Year:

2018

Language:

english

File:

PDF, 1.20 MB

english, 2018

15

ChemInform Abstract: Enhanced Charge-Transfer Kinetics by Anion Surface Modification of LiFePO 4 .

Park, Kyu-Sung, Xiao, Penghao, Kim, So-Yeon, Dylla, Anthony, Choi, Young-Min, Henkelman, Graeme, Stevenson, Keith J., Goodenough, John B.

Journal:

Year:

2012

File:

PDF, 19 KB

2012

16

In Situ Raman Study of Phase Stability of α-Li 3 V 2 (PO 4 ) 3 upon Thermal and Laser Heating

Membreño, Nellymar, Xiao, Penghao, Park, Kyu-Sung, Goodenough, John B., Henkelman, Graeme, Stevenson, Keith J.

Journal:

The Journal of Physical Chemistry C

Year:

2013

Language:

english

File:

PDF, 2.96 MB

english, 2013

17

Communication: From graphite to diamond: Reaction pathways of the phase transition

Xiao, Penghao, Henkelman, Graeme

Journal:

The Journal of Chemical Physics

Year:

2012

Language:

english

File:

PDF, 1.66 MB

english, 2012

18

Nudged elastic band method for solid-solid transition under finite deformation

Ghasemi, Arman, Xiao, Penghao, Gao, Wei

Journal:

The Journal of Chemical Physics

Year:

2019

Language:

english

File:

PDF, 1.86 MB

english, 2019

19

Kinetic Pathways Templated by Low-temperature Intermediates during Solid-state Synthesis of Layered Oxides

Bai, Jianming, Sun, Wenhao, Zhao, Jianqing, Wang, Dawei, Xiao, Penghao, Ko, Jun Young Peter, Huq, Ashfia, Ceder, Gerbrand, Wang, Feng

Journal:

Chemistry of Materials

Year:

2020

File:

PDF, 1016 KB

2020

20

Highly reversible oxygen redox in layered compounds enabled by surface polyanions

Chen, Qing, Pei, Yi, Chen, Houwen, Song, Yan, Zhen, Liang, Xu, Cheng-Yan, Xiao, Penghao, Henkelman, Graeme

Journal:

Nature Communications

Year:

2020

File:

PDF, 3.87 MB

2020

21

Detonation-induced transformation of graphite to hexagonal diamond

Stavrou, Elissaios, Bagge-Hansen, Michael, Hammons, Joshua A., Nielsen, Michael H., Steele, Bradley A., Xiao, Penghao, Kroonblawd, Matthew P., Nelms, Matthew D., Shaw, William L., Bassett, Will, Baste

Journal:

Physical Review B

Year:

2020

File:

PDF, 2.14 MB

2020

22

Basin constrained κ-dimer method for saddle point finding

Xiao, Penghao, Wu, Qiliang, Henkelman, Graeme

Journal:

The Journal of Chemical Physics

Year:

2014

Language:

english

File:

PDF, 3.92 MB

english, 2014

23

Suppressing the bipolar contribution to the thermoelectric properties of Mg2Si0.4Sn0.6 by Ge substitution

Zhang, Libin, Xiao, Penghao, Shi, Li, Henkelman, Graeme, Goodenough, John B., Zhou, Jianshi

Journal:

Journal of Applied Physics

Year:

2015

Language:

english

File:

PDF, 2.26 MB

english, 2015

24

Two-photon excited deep-red and near-infrared emissive organic co-crystals

Wang, Yu, Wu, Huang, Li, Penghao, Chen, Su, Jones, Leighton O., Mosquera, MartÃn A., Zhang, Long, Cai, Kang, Chen, Hongliang, Chen, Xiao-Yang, Stern, Charlotte L., Wasielewski, Michael R., Ratner, Ma

Journal:

Nature Communications

Year:

2020

File:

PDF, 3.16 MB

2020

25

Solid-state dimer method for calculating solid-solid phase transitions

Xiao, Penghao, Sheppard, Daniel, Rogal, Jutta, Henkelman, Graeme

Journal:

The Journal of Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.78 MB

english, 2014

26

Unification of algorithms for minimum mode optimization

Zeng, Yi, Xiao, Penghao, Henkelman, Graeme

Journal:

The Journal of Chemical Physics

Year:

2014

Language:

english

File:

PDF, 235 KB

english, 2014

27

Calculations of oxide formation on low-index Cu surfaces

Lian, Xin, Xiao, Penghao, Yang, Sheng-Che, Liu, Renlong, Henkelman, Graeme

Journal:

The Journal of Chemical Physics

Year:

2016

Language:

english

File:

PDF, 5.93 MB

english, 2016

28

Interfacial adhesion between graphene and silicon dioxide by density functional theory with van der Waals corrections

Gao, Wei, Xiao, Penghao, Henkelman, Graeme, Liechti, Kenneth M, Huang, Rui

Journal:

Journal of Physics D Applied Physics

Year:

2014

Language:

english

File:

PDF, 925 KB

english, 2014

29

Communication: Calculations of the (2 × 1)-O reconstruction kinetics on Cu(110)

Lian, Xin, Xiao, Penghao, Liu, Renlong, Henkelman, Graeme

Journal:

The Journal of Chemical Physics

Year:

2017

Language:

english

File:

PDF, 9.12 MB

english, 2017

30

Ridge-based bias potentials to accelerate molecular dynamics

Xiao, Penghao, Duncan, Juliana, Zhang, Liang, Henkelman, Graeme

Journal:

The Journal of Chemical Physics

Year:

2015

Language:

english

File:

PDF, 2.01 MB

english, 2015

31

Structural transformations in Li 2 MnSiO 4 : evidence that a Li intercalation material can reversibly cycle through a disordered phase

Chen, Qing, Xiao, Penghao, Pei, Yi, Song, Yan, Xu, Cheng-Yan, Zhen, Liang, Henkelman, Graeme

Journal:

Journal of Materials Chemistry A

Year:

2017

Language:

english

File:

PDF, 1.80 MB

english, 2017

32

Transformation of topologically close-packed β-W to body-centered cubic α-W: Comparison of experiments and computations

Barmak, Katayun, Liu, Jiaxing, Harlan, Liam, Xiao, Penghao, Duncan, Juliana, Henkelman, Graeme

Journal:

The Journal of Chemical Physics

Year:

2017

Language:

english

File:

PDF, 6.72 MB

english, 2017

33

Linear topology in amorphous metal oxide electrochromic networks obtained via low-temperature solution processing

Llordés, Anna, Wang, Yang, Fernandez-Martinez, Alejandro, Xiao, Penghao, Lee, Tom, Poulain, Agnieszka, Zandi, Omid, Saez Cabezas, Camila A., Henkelman, Graeme, Milliron, Delia J.

Journal:

Nature Materials

Year:

2016

Language:

english

File:

PDF, 1.36 MB

english, 2016

34

Localized Mg-vacancy states in the thermoelectric material Mg 2−δ Si 0.4 Sn 0.6

Zhang, Libin, Xiao, Penghao, Shi, Li, Henkelman, Graeme, Goodenough, John B., Zhou, Jianshi

Journal:

Journal of Applied Physics

Year:

2016

Language:

english

File:

PDF, 920 KB

english, 2016

35

Effect of fluorination and Li-excess on the Li migration barrier in Mn-based cathode materials

Jadidi, Zinab, Chen, Tina, Xiao, Penghao, Urban, Alexander, Ceder, Gerbrand

Journal:

Journal of Materials Chemistry A

Year:

2020

File:

PDF, 1.35 MB

2020

36

Enhanced Charge-Transfer Kinetics by Anion Surface Modification of LiFePO 4

Park, Kyu-Sung, Xiao, Penghao, Kim, So-Yeon, Dylla, Anthony, Choi, Young-Min, Henkelman, Graeme, Stevenson, Keith J., Goodenough, John B.

Journal:

Chemistry of Materials

Year:

2012

Language:

english

File:

PDF, 1.87 MB

english, 2012

37

Morphological Dependence of Lithium Insertion in Nanocrystalline TiO 2 (B) Nanoparticles and Nanosheets

Dylla, Anthony G., Xiao, Penghao, Henkelman, Graeme, Stevenson, Keith J.

Journal:

The Journal of Physical Chemistry Letters

Year:

2012

Language:

english

File:

PDF, 352 KB

english, 2012

38

post-perovskite phase transition under pressure

Xiao, Penghao, Cheng, Jin-Guang, Zhou, Jian-Shi, Goodenough, John B., Henkelman, Graeme

Journal:

Physical Review B

Year:

2013

Language:

english

File:

PDF, 1.10 MB

english, 2013

39

Calculations of Oxygen Stability in Lithium-Rich Layered Cathodes

Xiao, Penghao, Deng, Z. Q., Manthiram, A., Henkelman, Graeme

Journal:

The Journal of Physical Chemistry C

Year:

2012

Language:

english

File:

PDF, 1.24 MB

english, 2012

40

Breaking Down the Crystallinity: The Path for Advanced Lithium Batteries

Zu, Chenxi, Dolocan, Andrei, Xiao, Penghao, Stauffer, Shannon, Henkelman, Graeme, Manthiram, Arumugam

Journal:

Advanced Energy Materials

Year:

2016

Language:

english

File:

PDF, 6.91 MB

english, 2016

41

BarleyVarDB: a database of barley genomic variation

Tan, Cong, Chapman, Brett, Wang, Penghao, Zhang, Qisen, Zhou, Gaofeng, Zhang, Xiao-qi, Barrero, Roberto A, Bellgard, Matthew I, Li, Chengdao

Journal:

Year:

2020

File:

PDF, 1.22 MB

2020

42

Engineering the Mechanical Properties of Monolayer Graphene Oxide at the Atomic Level

Soler-Crespo, Rafael Antonio, Gao, Wei, Xiao, Penghao, Wei, Xiaoding, Paci, Jeffrey T., Henkelman, Graeme, Espinosa, Horacio D.

Journal:

The Journal of Physical Chemistry Letters

Year:

2016

Language:

english

File:

PDF, 2.86 MB

english, 2016

43

Simple Synthesis of Nanocrystalline Tin Sulfide/N-Doped Reduced Graphene Oxide Composites as Lithium Ion Battery Anodes

Youn, Duck Hyun, Stauffer, Shannon K., Xiao, Penghao, Park, Hunmin, Nam, Yejin, Dolocan, Andrei D., Henkelman, Graeme, Heller, Adam, Mullins, Charles Buddie

Journal:

Year:

2016

Language:

english

File:

PDF, 4.89 MB

english, 2016

44

Sodium Intercalation Behavior of Layered Na x NbS 2 (0 ≤ x ≤ 1)

Liao, Youhao, Park, Kyu-Sung, Xiao, Penghao, Henkelman, Graeme, Li, Weishan, Goodenough, John B.

Journal:

Chemistry of Materials

Year:

2013

Language:

english

File:

PDF, 3.71 MB

english, 2013

45

Understanding Surface Densified Phase in Ni-rich Layered Compounds

Xiao, Penghao, Shi, Tan, Huang, Wenxuan, Ceder, Gerbrand

Journal:

ACS Energy Letters

Year:

2019

Language:

english

File:

PDF, 2.39 MB

english, 2019

46

The interplay between thermodynamics and kinetics in the solid-state synthesis of layered oxides

Bianchini, Matteo, Wang, Jingyang, ClÃ©ment, RaphaÃ«le J., Ouyang, Bin, Xiao, Penghao, Kitchaev, Daniil, Shi, Tan, Zhang, Yaqian, Wang, Yan, Kim, Haegyeom, Zhang, Mingjian, Bai, Jianming, Wang, Feng,

Journal:

Nature Materials

Year:

2020

File:

PDF, 2.80 MB

2020

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