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
445 2010 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
333 2010 First-principles elastic constants of α-and θ-Al2O3 S Shang, Y Wang, ZK Liu
Applied Physics Letters 90 (10), 2007
321 2007 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
315 2010 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
275 2009 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
258 2010 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
244 2014 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
229 2009 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
215 2009 Exceptionally High Ionic Conductivity in Na3 P0.62 As0.38 S4 with Improved Moisture Stability for Solid‐State Sodium‐Ion Batteries Z Yu, SL Shang, JH Seo, D Wang, X Luo, Q Huang, S Chen, J Lu, X Li, ...
Advanced materials 29 (16), 1605561, 2017
209 2017 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
203 2016 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
193 2012 Effects of alloying elements on elastic properties of Ni by first-principles calculations DE Kim, SL Shang, ZK Liu
Computational Materials Science 47 (1), 254-260, 2009
187 2009 A piezoelectric, strain-controlled antiferromagnetic memory insensitive to magnetic fields H Yan, Z Feng, S Shang, X Wang, Z Hu, J Wang, Z Zhu, H Wang, Z Chen, ...
Nature nanotechnology 14 (2), 131-136, 2019
181 2019 Adsorption-controlled growth of La-doped BaSnO3 by molecular-beam epitaxy H Paik, Z Chen, E Lochocki, A Seidner H, A Verma, N Tanen, J Park, ...
Apl Materials 5 (11), 2017
166 2017 High performance anion exchange membrane fuel cells enabled by fluoropoly (olefin) membranes L Zhu, X Peng, SL Shang, MT Kwasny, TJ Zimudzi, X Yu, N Saikia, J Pan, ...
Advanced Functional Materials 29 (26), 1902059, 2019
157 2019 Structural and elastic properties of cubic and hexagonal TiN and AlN from first-principles calculations AJ Wang, SL Shang, Y Du, Y Kong, LJ Zhang, L Chen, DD Zhao, ZK Liu
Computational materials science 48 (3), 705-709, 2010
155 2010 Elastic properties of cubic and rhombohedral SL Shang, G Sheng, Y Wang, LQ Chen, ZK Liu
Physical Review B—Condensed Matter and Materials Physics 80 (5), 052102, 2009
142 2009 A comprehensive first-principles study of pure elements: vacancy formation and migration energies and self-diffusion coefficients SL Shang, BC Zhou, WY Wang, AJ Ross, XL Liu, YJ Hu, HZ Fang, ...
Acta Materialia 109, 128-141, 2016
141 2016 Lateral Versus Vertical Growth of Two-Dimensional Layered Transition-Metal Dichalcogenides: Thermodynamic Insight into MoS2 SL Shang, G Lindwall, Y Wang, JM Redwing, T Anderson, ZK Liu
Nano letters 16 (9), 5742-5750, 2016
136 2016 
Zi-Kui Liu, Dorothy Pate Enright Profes...The Pennsylvania State UniversityEmail verificata su psu.edu
