Tzu-Ray Shan: search on Z-Library

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1

Optimizing the performance of reactive molecular dynamics simulations for many-core architectures

Aktulga, Hasan Metin, Knight, Chris, Coffman, Paul, O’Hearn, Kurt A, Shan, Tzu-Ray, Jiang, Wei

Journal:

International Journal of High Performance Computing Applications

Year:

2018

Language:

english

File:

PDF, 824 KB

english, 2018

2

Charge-optimized many-body (COMB) potential for zirconium

Noordhoek, Mark J., Liang, Tao, Lu, Zizhe, Shan, Tzu-Ray, Sinnott, Susan B., Phillpot, Simon R.

Journal:

Journal of Nuclear Materials

Year:

2013

Language:

english

File:

PDF, 1.91 MB

english, 2013

3

Extended asymmetric hot region formation due to shockwave interactions following void collapse in shocked high explosive

Shan, Tzu-Ray, Wixom, Ryan R., Thompson, Aidan P.

Journal:

Physical Review B

Year:

2016

Language:

english

File:

PDF, 2.79 MB

english, 2016

4

Amorphization of α-quartz and comparative study of defects in amorphized quartz and Si nanocrystals embedded in amorphous silica

Flyura Djurabekova, Matilda Backholm, Marie Backman, Olli H. Pakarinen, Juhani Keinonen, Kai Nordlund, Tzu-Ray Shan, Bryce D. Devine, Susan B. Sinnott

Journal:

Nuclear Instruments and Methods in Physics Research Section B: Beam Interactions with Materials and Atoms

Year:

2010

Language:

english

File:

PDF, 224 KB

english, 2010

5

Atomistic simulations of the adsorption and migration barriers of Cu adatoms on ZnO surfaces using COMB potentials

Yu-Ting Cheng, Tzu-Ray Shan, Bryce Devine, Donghwa Lee, Tao Liang, Beverly B. Hinojosa, Simon R. Phillpot, Aravind Asthagiri, Susan B. Sinnott

Journal:

Surface Science

Year:

2012

Language:

english

File:

PDF, 804 KB

english, 2012

6

Development of a ReaxFF Reactive Force Field for Ammonium Nitrate and Application to Shock Compression and Thermal Decomposition

Shan, Tzu-Ray, van Duin, Adri C. T., Thompson, Aidan P.

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 2.54 MB

english, 2014

7

interfaces using a variable-charge interatomic potential

Shan, Tzu-Ray, Devine, Bryce D., Phillpot, Simon R., Sinnott, Susan B.

Journal:

Physical Review B

Year:

2011

Language:

english

File:

PDF, 1.05 MB

english, 2011

8

Reactive atomistic simulations of shock-induced initiation processes in mixtures of ammonium nitrate and fuel oil

Thompson, Aidan P, Shan, Tzu-Ray

Journal:

Journal of Physics Conference Series

Year:

2014

Language:

english

File:

PDF, 16.36 MB

english, 2014

9

Modification of poly(methyl methacrylate) by keV Ar deposition

Ya-Ting Su, Tzu-Ray Shan, Susan B. Sinnott

Journal:

Nuclear Instruments and Methods in Physics Research Section B: Beam Interactions with Materials and Atoms

Year:

2009

Language:

english

File:

PDF, 4.18 MB

english, 2009

10

Classical atomistic simulations of surfaces and heterogeneous interfaces with the charge-optimized many body (COMB) potentials

Liang, Tao, Shan, Tzu-Ray, Cheng, Yu-Ting, Devine, Bryce D., Noordhoek, Mark, Li, Yangzhong, Lu, Zhize, Phillpot, Simon R., Sinnott, Susan B.

Journal:

Materials Science and Engineering: R: Reports

Year:

2013

Language:

english

File:

PDF, 5.29 MB

english, 2013

11

A charge optimized many-body (comb) potential for titanium and titania

Cheng, Yu-Ting, Shan, Tzu-Ray, Liang, Tao, Behera, Rakesh K, Phillpot, Simon R, Sinnott, Susan B.

Journal:

Journal of Physics Condensed Matter

Year:

2014

Language:

english

File:

PDF, 1.48 MB

english, 2014

12

and amorphous silica

Shan, Tzu-Ray, Devine, Bryce D., Hawkins, Jeffery M., Asthagiri, Aravind, Phillpot, Simon R., Sinnott, Susan B.

Journal:

Physical Review B

Year:

2010

Language:

english

File:

PDF, 597 KB

english, 2010

13

Reparameterization of the REBO-CHO potential for graphene oxide molecular dynamics simulations

Fonseca, Alexandre, Lee, Geunsik, Borders, Tammie, Zhang, Hengji, Kemper, Travis, Shan, Tzu-Ray, Sinnott, Susan, Cho, Kyeongjae

Journal:

Physical Review B

Year:

2011

Language:

english

File:

PDF, 802 KB

english, 2011

14

and amorphous silica [Phys. Rev. B 82 , 235302 (2010)]

Shan, Tzu-Ray, Devine, Bryce D., Hawkins, Jeffery M., Asthagiri, Aravind, Phillpot, Simon R., Sinnott, Susan B.

Journal:

Physical Review B

Year:

2010

File:

PDF, 22 KB

2010

15

Variable charge many-body interatomic potentials

Shin, Yun Kyung, Shan, Tzu-Ray, Liang, Tao, Noordhoek, Mark J., Sinnott, Susan B., van Duin, Adri C.T., Phillpot, Simon R.

Journal:

Year:

2012

Language:

english

File:

PDF, 946 KB

english, 2012

16

Shock-induced hotspot formation and chemical reaction initiation in PETN containing a spherical void

Shan, Tzu-Ray, Thompson, Aidan P

Journal:

Journal of Physics Conference Series

Year:

2014

Language:

english

File:

PDF, 5.36 MB

english, 2014

17

O interfaces using charge-optimized many-body potentials

Devine, Bryce, Shan, Tzu-Ray, Cheng, Yu-Ting, McGaughey, Alan J. H., Lee, Minyoung, Phillpot, Simon R., Sinnott, Susan B.

Journal:

Physical Review B

Year:

2011

Language:

english

File:

PDF, 1.03 MB

english, 2011

18

The Effects of Operating Parameters on Micro-Droplet Formation in a Piezoelectric Inkjet Printhead Using a Double Pulse Voltage Pattern

Lin, Huey-Jiuan, Wu, Hsuan-Chung, Shan, Tzu-Ray, Hwang, Weng-Sing

Journal:

MATERIALS TRANSACTIONS

Year:

2006

Language:

english

File:

PDF, 265 KB

english, 2006

19

Classical interatomic potential for orthorhombic uranium

Li, Yangzhong, Shan, Tzu-Ray, Liang, Tao, Sinnott, Susan B, Phillpot, Simon R

Journal:

Journal of Physics Condensed Matter

Year:

2012

Language:

english

File:

PDF, 1.24 MB

english, 2012

20

Atomistic Simulation of Orientation Dependence in Shock-Induced Initiation of Pentaerythritol Tetranitrate

Shan, Tzu-Ray, Wixom, Ryan R., Mattsson, Ann E., Thompson, Aidan P.

Journal:

Journal of Physical Chemistry B

Year:

2013

Language:

english

File:

PDF, 1.52 MB

english, 2013

21

O interfaces using charge-optimized many-body potentials [Phys. Rev. B 84 , 125308 (2011)]

Devine, Bryce, Shan, Tzu-Ray, Cheng, Yu-Ting, McGaughey, Alan J. H., Lee, Minyoung, Phillpot, Simon R., Sinnott, Susan B.

Journal:

Physical Review B

Year:

2012

Language:

english

File:

PDF, 44 KB

english, 2012

22

Charge-optimized many-body potential for the hafnium/hafnium oxide system

Shan, Tzu-Ray, Devine, Bryce D., Kemper, Travis W., Sinnott, Susan B., Phillpot, Simon R.

Journal:

Physical Review B

Year:

2010

Language:

english

File:

PDF, 573 KB

english, 2010

23

Study of Micro-Droplet Behavior for a Piezoelectric Inkjet Printing Device Using a Single Pulse Voltage Pattern

Wu, Hsuan-Chung, Shan, Tzu-Ray, Hwang, Weng-Sing, Lin, Huey-Jiuan

Journal:

MATERIALS TRANSACTIONS

Year:

2004

Language:

english

File:

PDF, 194 KB

english, 2004

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