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Yi Wang
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Year
Efficient stochastic generation of special quasirandom structures
A van de Walle, P Tiwary, M de Jong, DL Olmsted, M Asta, A Dick, D Shin, ...
Calphad 42, 13-18, 2013
8182013
Thermodynamic properties of Al, Ni, NiAl, and Ni3Al from first-principles calculations
Y Wang, ZK Liu, LQ Chen
Acta Materialia 52 (9), 2665-2671, 2004
5132004
Ab initio lattice stability in comparison with CALPHAD lattice stability
Y Wang, S Curtarolo, C Jiang, R Arroyave, T Wang, G Ceder, LQ Chen, ...
Calphad 28 (1), 79-90, 2004
4202004
First-principles thermodynamics from phonon and Debye model: Application to Ni and Ni3Al
SL Shang, Y Wang, DE Kim, ZK Liu
Computational Materials Science 47 (4), 1040-1048, 2010
3602010
First-principles calculations of pure elements: Equations of state and elastic stiffness constants
SL Shang, A Saengdeejing, ZG Mei, DE Kim, H Zhang, S Ganeshan, ...
Computational Materials Science 48 (4), 813-826, 2010
2872010
First-principles calculation of self-diffusion coefficients
M Mantina, Y Wang, R Arroyave, LQ Chen, ZK Liu, C Wolverton
Physical review letters 100 (21), 215901, 2008
2692008
First-principles elastic constants of α-and θ-Al2O3
S Shang, Y Wang, ZK Liu
Applied Physics Letters 90 (10), 101909, 2007
2692007
First principles impurity diffusion coefficients
M Mantina, Y Wang, LQ Chen, ZK Liu, C Wolverton
Acta Materialia 57 (14), 4102-4108, 2009
2602009
A mixed-space approach to first-principles calculations of phonon frequencies for polar materials
Y Wang, JJ Wang, WY Wang, ZG Mei, SL Shang, LQ Chen, ZK Liu
Journal of Physics: Condensed Matter 22 (20), 202201, 2010
2512010
Elastic constants of binary Mg compounds from first-principles calculations
S Ganeshan, SL Shang, H Zhang, Y Wang, M Mantina, ZK Liu
Intermetallics 17 (5), 313-318, 2009
2272009
A first-principles approach to finite temperature elastic constants
Y Wang, JJ Wang, H Zhang, VR Manga, SL Shang, LQ Chen, ZK Liu
Journal of Physics: Condensed Matter 22 (22), 225404, 2010
2152010
High‐performance polymers sandwiched with chemical vapor deposited hexagonal boron nitrides as scalable high‐temperature dielectric materials
A Azizi, MR Gadinski, Q Li, MA AlSaud, J Wang, Y Wang, B Wang, F Liu, ...
Advanced Materials 29 (35), 1701864, 2017
2032017
Generalized stacking fault energy, ideal strength and twinnability of dilute Mg-based alloys: A first-principles study of shear deformation
SL Shang, WY Wang, BC Zhou, Y Wang, KA Darling, LJ Kecskes, ...
Acta Materialia 67, 168-180, 2014
1982014
Calculated equation of state of Al, Cu, Ta, Mo, and W to 1000 GPa
Y Wang, D Chen, X Zhang
Physical review letters 84 (15), 3220, 2000
1922000
Effect of alloying elements on the elastic properties of Mg from first-principles calculations
S Ganeshan, SL Shang, Y Wang, ZK Liu
Acta Materialia 57 (13), 3876-3884, 2009
1872009
Enthalpies of formation of magnesium compounds from first-principles calculations
H Zhang, S Shang, JE Saal, A Saengdeejing, Y Wang, LQ Chen, ZK Liu
Intermetallics 17 (11), 878-885, 2009
1752009
Effect of substrate-induced strains on the spontaneous polarization of epitaxial thin films
JX Zhang, YL Li, Y Wang, ZK Liu, LQ Chen, YH Chu, F Zavaliche, ...
Journal of applied physics 101 (11), 114105, 2007
1492007
Diffusion coefficients of alloying elements in dilute Mg alloys: A comprehensive first-principles study
BC Zhou, SL Shang, Y Wang, ZK Liu
Acta Materialia 103, 573-586, 2016
1482016
First-principles calculations of twin-boundary and stacking-fault energies in magnesium
Y Wang, LQ Chen, ZK Liu, SN Mathaudhu
Scripta Materialia 62 (9), 646-649, 2010
1452010
Effects of alloying element and temperature on the stacking fault energies of dilute Ni-base superalloys
SL Shang, CL Zacherl, HZ Fang, Y Wang, Y Du, ZK Liu
Journal of Physics: Condensed Matter 24 (50), 505403, 2012
1302012
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