Dr. Zhang

Publications

  1. H.R. Yue, X.H. Tan, H. Zhang, T. Tian, J. Liu, 2026, Phase control in vanadium recovery via matrix-introduced interfacial atomic diffusion, Journal of Hazardous Materials, 515, 142915

  2. Y. Li, J.R. Zhang, X. Liu, Y.M. Zeng, Z.H. Jin, H. Zhang, 2026, Microscopic origin of pressure-dependent diffusion in supercritical carbon dioxide from ab initio molecular dynamics, Journal of Chemical Physics, 165, 064507

  3. G.C. Lv, Q.Y. Kong, H. Zhang, P. Qian, 2026, Primary radiation damage and defect clustering in molybdenum: a high-fidelity benchmark study based on the NEP-ZBL machine learning potential, Modelling and Simulation in Materials Science and Engineering, 34, 065002

  4. N. Zaghian, H.R. Yue, H. Zhang, Y.M. Zeng, J. Liu, 2026, Cr-assisted rust densification governs hydrogen entry–retention trade-off in pipeline steels, International Journal of Hydrogen Energy, 231, 154901

  5. W.L. Yang, X.L. Wang, A. Gross, H. Zhang, J. Liu, 2026, From phase state to pit pattern: A wetting-controlled mechanism for localized corrosion, Acta Materialia, 316, 122489

  6. J.Y. Cui, Y. Li, H. Zhang, D.G. Ivey, 2026, Interplay of surface effects and electrolyte properties governs zinc stripping behavior in aqueous electrolytes, Electrochimica Acta, 570, 148953

  7. J.R. Zhang, J.F. Douglas, H. Zhang, 2026, Hierarchical relaxation and the microscopic origin of fast Li+ ions transport in Li7La3Zr2O12, Journal of Chemical Physics, 164, 104501

  8. Y.F. Li, C. Chen, X.S. Xie, Y. Yang, Y.X. Xue, X.H. Tan, K.R. Jiang, N. Chen, M.G. Xie, H. Zhang. Z. Li, 2026, Simultaneously breaking the axial and planar symmetry further boosts the oxygen electroreduction activities of Fe-N4 sites, Applied Catalysis B: Environment and Energy , 390, 126644

  9. X.L. Gao, X. Zhao, Y. Li, Z.P. Deng, Z.Q. Zhang, Y.M. Zeng, H. Zhang, G. Li, 2026, Sabatier-guided atomic-density engineering of Fe single-atom catalysts for high-performance oxygen reduction reaction, Sustainable Materials and Technologies, 48, e01933

  10. R.K. Chai, D.L. Yang, Y.T. Liu, J.P. Li, P. Huang, Y.X. Sun, Y.T. He, H. Zhang, H.B. Zeng, 2026, Interfacial interactions between oil and porous calcium carbonate in brine: Insights for enhanced oil recovery and spill remediation, Journal of Colloid and Interface Science, 714, 140174

  11. G.C. Lv, G.L. Lyu, W.J. Qian, H. Zhang, S.Z. Li, P. Qian, 2026, First-principles study of the interfacial wetting behavior of MXene/Cu composites, ACS Omega,11, 11245-11255

  12. Z.J. Li, K.Q. Qu, Y. Li, X.J. Lu, H. Zhang, Z.Y. Bai, X.L. Wang, 2026, Synergistic anode and cathode stabilization in aqueous Zn-ion batteries via a pH-stabilizing and interface-adsorbing additive, Small, in press

  13. Y. Li, J.R. Zhang, H.B. Zeng, H. Zhang, 2026, Interactions between calcium ion and functional groups of organic scale inhibitors in aqueous solutions: an ab initio study, Physical Chemistry Chemical Physics, 28, 2412-2424

  14. Y.X. Wu, Z.W. Zhao, Y. Fei, H. Zhang, G. Li, 2025, Localized high-concentration electrolyte with water-miscible diluent enables stable zinc deposition and long-life aqueous zinc metal batteries, Advanced Functional Materials , e26034

  15. S. Yang, Y. Li, Q. Zhou, X. Lv, Y.X. Sun, H.B. Zeng, Z.J. Zhang, H. Zhang, 2025, A novel anionic-nonionic mixed collector (SDBS/TOAM): synergistic effects and adsorption mechanism for the enhanced flotation of low-grade fluorapatite, Separation and Purification Technology, 387, 136603

  16. Y. Chen, J.R. Zhang, H. Zhang, J.S. Guo, C.W. Yu, G. Li, 2025, Harnessing metal ion-Tannic acid complexes to engineer an artificial SEI for ultra-stable zinc metal batteries, ACS Applied Materials & Interfaces, 17, 59367-59377

  17. W.S. Yang, Z.Q. Zhao, W.Y. Zhu, L. Gong, Y.X. Sun, H.Y. Yang, L. Zhang, W.F. Zhang, H. Zhang, F. Zhou, X.W. Peng, H.B. Zeng, 2025, Biomimetic ion-orchestrated hierarchical armored hydrogel coating for robust and multifunctional surface protection, Advanced Functional Materials, e22778

  18. Y.F. Li, H.L. Wang, C. Chen, X.S. Xie, Y. Yang, X.H. Tan, K.R. Jiang, N. Chen, H. Zhang, Z. Li, 2025, Ten thousand hour stable zinc air batteries via Fe and W dual atom sites, Nature Communications, 16, 8085

  19. H.T. Ma, Y.Y. Wang, Z.Q. Zhao, Y.X. Sun, W.F. Zhang, X.H. Mao, Y. Hu, H. Zhang, H.B. Zeng, 2025, Adsorption and interaction mechanisms of asphaltene subfractions on silica surfaces, Journal of Colloid and Interface Science, 702, 138832

  20. A. Sheikhzadeh, J. Liu, Y.M. Zeng, H. Zhang, 2025, First-principles evaluation of alloying effects on hydrogen adsorption and trapping at grain boundaries in pipeline steels, Energy & Fuels, 39, 15210-15223

  21. J.R. Zhang, J.F. Douglas, H. Zhang, 2025, String-like collective motion mediates the martensitic alpha-beta transition in titanium, Journal of Chemical Physics, 163, 044504

  22. X. Xing, C. H. Wang, J.G. Liu, G. Cui, Y.F. Cheng, H. Zhang, 2025, Effects of alloy elements on the hydrogen adsorption behavior of pipeline steel: A review, Renewable and Sustainable Energy Reviews, 222, 116003

  23. N. Yang, L.J. Zhang, L.Y. Jiao, H. Chi, Y.C. Li, K.G. Luo, S. Fan, J. Zhong, H. Zhang, 2025, Enhancing formability via reciprocating counter-roller spinning: Dynamic coordination of complex flexible return path, Journal of Materials Processing Technology, 343, 118988

  24. Y. Fei, M. Li, Z.F. Li, D.C. Guan, W.T. Jia, H. Zhang, K. Amine, G. Li, 2025, Revisiting the impact of anion selection on sulfur redox reaction kinetics for high sulfur loading lithium–sulfur batteries, Advanced Materials, 37, 2507459

  25. Z.F. Li, Y. Li, Y. Fei, P.C. Li, S.Y. Hung, H. Zhang, G. Li, 2025, Synergistic cathode-electrolyte engineering for enhanced longevity in Li-S batteries, Advanced Materials, 37, 2505196

  26. H.T. Ma, D.L. Yang, Z.L. Li, Y.X. Sun, Y. Hu, X.H. Mao, B.S. Lu, H. Zhang, H.B. Zeng, 2025, Probing the adsorption behavior and molecular interactions of asphaltene subfractions at Water–Toluene/Heptol interface, Fuel, 389, 134577

  27. Z.W. Zhao, P.C. Li, Y.X. Wu, Z.W. Chai, H. Zhang, G. Li, 2025, Fluorinated interphase enabled by lithium salt-driven electrical double-layer modulation for advanced zinc metal batteries, Advanced Functional Materials, 12, 2506270

  28. P.C. Li, Z.W. Zhao, Y. Fei, H. Zhang, G. Li, 2025, LiNO3-based electrolyte with fast kinetics for lithium metal batteries under practical conditions, Advanced Energy Materials, 15, 2500882

  29. Y. Yang, H.L. Wang, M. Fujii, Y. Hu, Y.F. Li, X.S. Xie, X.H. Tan, K.R. Jiang, S.L. Zhai, N. Chen, H. Zhang, Z. Li, 2025, Regulating second-shell coordination in molybdenum single-atom catalysts for efficient photocatalytic nitrogen fixation, Chemical Engineering Journal, 515, 163762

  30. J.Y. Cui, Y. Li, H. Zhang, D.G. Ivey, 2025, Revealing Zn stripping and plating behavior in ZnSO4, Zn(ClO4)2, and ZnCl2 as a function of current density and capacity in aqueous zinc ion batteries, Electrochimica Acta, 530, 146418

  31. Y.M. Chen, Y.X. Sun, R.F. Feng, H. Zhang, H.B. Zeng, X.L. Wang, 2025, Synergy of strongly coordinating salts and weakly coordinating solvents enables stable and fast-kinetics zinc metal batteries, ACS Nano, 19, 16913-16929

  32. X.L. Gao, Y. Li, Z.Q. Zhang, H. Zhang, G. Li, 2025, Architecting hydrangea-inspired nitrogen-doped hollow carbon with isolated Co atoms for superior oxygen reduction catalysis, Journal of Materials Chemistry A, 13, 14631-14645

  33. H.L. Wang, Z. Li, H. Zhang, 2025, Ab initio study of atomically dispersed catalysts on original and B-doped corrugated carbon nitride surface for effective nitrogen reduction, Applied Surface Science, 689, 162545

  34. A.L. Wang, B.G. Wang, R.J. Jiang, R.Y. Nie, G. Cui, J.G. Liu, Y. Zhang, H. Zhang, X. Xing, 2025, Experimental study on hydrogen-induced crack propagation of X80 steel under alternating pressure fluctuations, Materials, 18, 947

  35. Q. Sun, D.L. Yang, J.S. Chen, Z.Q. Zhao, H. Zhang, H. Zhong, H.B. Zeng, 2025, Thioether-bridged surfactants for interfacial hydrophobic regulation and enhanced mineral flotation recovery, AIChE Journal, 71, e18772

  36. X.W. Peng, H. Zhang, H.B. Zeng, 2025, Covalent organic framework materials with advanced topologies for efficient methane adsorption, Science China Materials, 68, 1298-1299

  37. H.F. Sun, M.F. Li, X.H. Tan, H. Zhang, J. Liu, 2025, Understanding thermally grown complex concentrated oxides on AlCrTiVNi5 alloy for high-temperature applications, Materials & Design, 251, 113728

  38. X.Z. Zhang, Y. Li, J.L. Wang, Y. Fei, H. Zhang, G. Li, 2025, Enhancing Li deposition behavior through valence gradient-assisted iron layer, Nano Letters, 25, 1783-1791

  39. Z.Q. Zhang, C.Y., Qiao, J.Q. Li, P.C. Li, H. Zhang, Q.X. Liu, H.B. Zeng, G. Li, 2025, Weakened hydrophobic interactions enhance bubble release in electrocatalytic water-splitting, Applied Catalysis B: Environment and Energy, 366, 125019

  40. J.J. Bian, W.K. Yuan, L. Yang, Y. Ding, X.H. Yu, Z.S. Shao, H. Zhang, G.F. Wang, 2025, Influence of planar defects on the mechanical behaviors of spherical metallic nanoparticles, Physica Scripta, 100, 015921

  41. Z.W. Chai, Z.W. Zhao, P.C. Li, H. Zhang, G. Li, 2025, Inner Helmholtz layer control through co-solvent strategies for high-performance copper hexacyanoferrate//zinc battery, Journal of Colloid and Interface Science, 683, 784-792

  42. F. Khalid, M.F. Li, J. Liu, H. Zhang, 2024, Oxygen adsorption, absorption and diffusion in FeCrNi medium entropy alloy: an ab initio study, ChemPhysChem, 25, e202400885

  43. J.F. Douglas, Q.L. Yuan, J.R. Zhang, H. Zhang, W.S. Xu, 2024, A dynamical system approach to relaxation in glass-forming liquidsi, Soft Matter, 20, 9140-9160

  44. M.F. Li, H. Zhang, H. Henein, J. Liu, 2024, Hydrogen Trapping in Precipitates in High-Strength Steel: Insights from Various Coherent and Stress Conditions, International Journal of Hydrogen Energy, 92, 1356-1365

  45. Y. Fei, Z.F. Li, P.C. Li, X.Z. Zhang, Z.X. Xu, W.J. Deng, H. Zhang, G. Li, 2024, Dual-functional metal-organic framework freestanding aerogel boosts sulfur reduction reaction for lithium-sulfur batteries, ACS Applied Materials & Interfaces, 16, 40, 53833-53842

  46. J.Y. Cui, Y.M. Chen, Y. Dong, H. Zhang, D.G. Ivey, 2024, Sodium succinate as functional electrolyte additive to achieve highly reversible zinc-ion batteries, Journal of Materials Chemistry A, 2024, 12, 28475-28485

  47. Y.Y. Huang, X.H. Mao, D.L. Yang, C.Y. Qiao, L. Zhang, J.Y. Wang, H. Zhang, H.B. Zeng, 2024, Probing the interactions between asphaltenes and a PEO-PPO demulsifier at oil–water interface: Effect of temperature, Journal of Colloid and Interface Science, 678, 1096-1111

  48. A. Sheikhzadeh, J. Liu, Y.M. Zeng, H. Zhang, 2024, A combination of first-principle and thermodynamics study of high-pressured hydrogen uptake on doped Fe(100) surface, International Journal of Hydrogen Energy, 81, 727-738

  49. Z.M. Li, Z.P. Deng, Y. Dong, Y. Li, X.L. Wang, G. Li, 2024, Revealing the role of 1T- & 2H- molybdenum Disulfide/Nickel sulfide heterojunction for efficient overall water splitting, Journal of Colloid and Interface Science, 678, 666-675

  50. G.C. Lv, S.Z. Li, H. Zhang, W.J. Qian, J. Cheng, P. Qian, 2024, CO2 adsorption on a K-promoted MgO surface: A DFT theoretical study, Surface Science , 749, 122575

  51. Z.W. Zhao, P.C. Li, Z.W. Chai, H. Zhang, G. Li, 2024, Mastering cathode and anode electrolyte interphases for vanadium-based zinc batteries via solvation structure control, Nano Energy, 128, 109822

  52. M.F. Li, A. Gross, B. Taylor, H. Zhang, J. Liu, 2024, Effects of Cl-ion and temperature variations on steel corrosion in supercritical CO2 saturated aqueous environments, Process Safety and Environmental Protection, 187, 1446-1453

  53. Y. Li, J.R. Zhang, H.B. Zeng, H. Zhang, 2024, Ion association behaviors in the initial stage of calcium carbonate formation: An ab initio study, Journal of Chemical Physics, 161, 014503

  54. D.L. Yang, H. Zhang, H.B. Zeng, 2024, Photocontrolled polymer adhesives facilitate the assembly of hydrogels for soft robotics, Science China Chemistry

  55. X.H. Mao, C.Y. Qiao, Z.Q. Zhao, C. Huang, D.L. Yang, H.T. Ma, Y. Hu, H. Zhang, L.P. Zhu, H.B. Zeng, 2024, Probing the interfacial behaviors of interfacially active and non-active asphaltenes and their impact on emulsion stability, Journal of Colloid and Interface Science, in press

  56. G.C. Lv, S.Z. Li, H. Zhang, C.L. Zhu, J. Cheng, P. Qian, 2024, CO2 adsorption by Cr, Mn, Fe, Co, Ni doped MgO(1 0 0) surfaces: A first-principles study, Separation and Purification Technology , 353, 128613

  57. P.C. Li, Z.Q. Zhang, Z.W. Zhao, J.Q. Li, Z.X. Xu, H. Zhang, G. Li, 2024, Dipole moment influences the reversibility and corrosion of lithium metal anodes, Advanced Materials, 2406359

  58. Y. Yang, H.L. Wang, X.H. Tan, K.R. Jiang, S.L. Zhai, Y.F. Li, X.S. Xie, N. Chen, H. Zhang, Z. Li, 2024, Boosting electrochemical nitrogen reduction via axial coordination engineering on single-iron-atom catalysts, Advanced Functional Materials, 2403535

  59. Y. Dong, Q. Sun, Y.M. Chen, W.J. Deng, H. Zhang, H.B. Zeng, G.Y. Liu, X.L. Wang, 2024, Spontaneous anode-molecule interface triggers highly reversible zinc anode, Energy Storage Materials, 70, 103465

  60. Q.Y. Peng, T. Wang, D.L. Yang, X.W. Peng, H. Zhang, H.B. Zeng, 2024, Recent advances in coacervation and underlying noncovalent intermolecular interactions, Progress in Polymer Science, 153, 101827

  61. X.Z. Zhang, J.L. Wang, H.L. Wang, H. Huang, H. Zhang, G. Li, 2024, Unlocking dendrite-free zinc metal anodes through anti-corrosive and Zn-ion-regulating interlayer, Next Energy, 4, 100124

  62. D.L. Yang, H. Zhang, H.B. Zeng, 2024, Structural integration of solar desalination system, Science China Materials

  63. J.R. Zhang, H. Zhang, J.F. Douglas, 2024, A closer examination of the nature of atomic motion in the interfacial region of crystals upon approaching melting, Journal of Chemical Physics, 160, 114506

  64. M.F. Li, H.F. Sun, X.H. Tan, H. Zhang, J. Liu, 2024, A novel entropy-stabilized oxide coating thermally grown from a valve metal-based complex concentrated alloy, Materials Today, 74, 46-57

  65. H. Huang, Z.W. Zhao, P.C. Li, H. Zhang, G. Li, 2024, Optimizing electrolyte systems for stable and low-temperature zinc-ion batteries via efficient coordinator, Journal of Power Sources, 602, 234340

  66. X. Xing, Z.W. Pang, H. Zhang, J.G. Liu, G. Cui, 2024, Study of temperature effect on hydrogen embrittlement in X70 pipeline steel, Corrosion Science, 230, 111939

  67. L. Gong, F.Y. Wu, M.F. Pan, J. Huang, H. Zhang, J.L. Luo, H.B. Zeng, 2024, Exploring the mechanisms of calcium carbonate deposition on various substrates with implications for effective anti-fouling material selection, Petroleum Science, in press

  68. P.C. Li, Z.Q. Zhang, Z.W. Zhao, X.Z. Zhang, H. Zhang, G. Li, 2024, Localized medium concentration electrolyte with fast kinetics for lithium metal batteries, Angewandte Chemie International Edition, 63, e202319090

  69. Y.M. Chen, Z.P. Deng, Y.X. Sun, Y. Li, H. Zhang, G. Li, H.B. Zeng, X.L. Wang, 2024, Ultrathin zincophilic interphase regulated electric double layer enabling highly stable aqueous zinc-ion batteries, Nano-Micro Letters, 16, 96

  70. X.L. Gao, Y. Li, H.X. Li, X.Z. Zhang, Z.Q. Zhang, H. Zhang, G. Li, 2024, Surface-induced Co/Co9S8 nanodots embedded in nitrogen-doped hollow carbon nanocubes for high-performance overall water splitting, Sustainable Materials and Technologies, 39, e00787

  71. H.F. Sun, M.F. Li, H. Zhang, J. Liu, 2024, Phase transformation and diffusion in high-temperature oxidation of FeCrNi medium entropy alloy, Corrosion Science, 227, 111685

  72. O.B. Wani, D.L. Yang, S. Manzoor, M. Shoaib, S. Khan, H. Zhang, H.B. Zeng, B. Klein, E. Bobicki, 2023, Modulating particle-particle interaction in Phyllosilicate Serpentine aqueous suspensions using Sodium Citrate, Journal of Environmental Chemical Engineering, 111213

  73. G.C. Lv, W.J. Qian, H. Zhang, Y. Su, P. Qian, 2023, Role of -O functional groups at the Ti3C2O2(MXene)/Al interface in enhancing the mechanical properties of aluminum matrix composites: A first-principles study, Applied Surface Science, 642, 158608

  74. Y. Dong, S. Liu, W.J. Deng, H. Zhang, G.Y. Liu, X.L. Wang, 2023, Modulating electronic structures of bimetallic Co-Fe sulfide ultrathin nanosheet supported on g-C3N4 for highly electrocatalytic hydrogen evolution performance, Journal of Colloid and Interface Science, 653, 1557-1565

  75. D.L. Yang, H. Zhang, H.B. Zeng, 2023, Programmable shape memory polymers: Intermolecular and interfacial interaction mechanisms, Science China Materials, 66, 4519

  76. Y. Dong, Z.P. Deng, H. Zhang, G.Y. Liu, X.L. Wang, 2023, A highly active and durable hierarchical electrocatalyst for large-current-density water splitting, Nano Letters, 23, 9087-9095

  77. D.L. Yang, C.Y. Qiao, X.H. Mao, J.Y. Wang, L. Xie, J.S. Chen, X.W. Peng, Q.Y. Peng, T. Wang, Q. Liu, H. Zhang, H.B. Zeng, 2023, Probing the surface forces between air bubbles and bitumen via direct force measurements: effects of aqueous chemistry, Fuel, 357, 129865

  78. L.Y. Zhu, W.S. Lyu, X.H. Mao, Z.Q. Zhao, D.L. Yang, H. Zhang, K. Wang, P. Yang, H.B. Zeng, 2023, Effect of solution pH and polyethylene oxide concentration on surface/interface properties, flocculation and rheology of concentrated monodisperse ultrafine tailings slurry, Powder Technology, 430, 119002

  79. B.L. Xiang, M.N. Ashani, Z.Q. Zhang, R. Manica, H. Zhang, Q.X. Liu, 2023, Competitive adsorption between sodium citrate and naphthenic acids on alumina surfaces: Experimental and computational study, Minerals Engineering, 203, 108324

  80. Y. Li, H.B. Zeng, H. Zhang, 2023, Atomistic simulations of nucleation and growth of CaCO3 with the influence of inhibitors: A review, Materials Genome Engineering Advances, e4

  81. Y. Li, H.B. Zeng, H. Zhang, 2023, Influence of impurity metal doping on calcite growth: a first-principles study, Applied Surface Science, 637, 157927

  82. Z.X. Xu, Y. Li, G. Li, H. Zhang, X.L. Wang, 2023, Reversible Zinc Powder Anode via Crystal Facet Engineering, Matter, 6, 3075-3086

  83. H. Zhang, X.Y. Wang, J.R. Zhang, H.B. Yu, J.F. Douglas, 2023, Approach to hyperuniformity in a metallic glass-forming material exhibiting a fragile to strong glass transition, The European Physical Journal E, 46, 50

  84. D.L. Yang, Z.Q. Zhao, L. Gong, Y.X. Sun, X.W. Peng, Q.Y. Peng, T. Wang, Q. Liu, H. Zhang, H.B. Zeng, 2023, Surface interaction mechanisms of air bubbles, asphaltenes and oil drops in aqueous solutions with implications for interfacial engineering processes, Journal of Colloid and Interface Science, 647, 264-276

  85. Q. Sun, J.S. Chen, Z.Q. Zhao, D.L. Yang, Y.Y. Xiao, H. Zhang, X. Ma, H. Zhong, H.B. Zeng, 2023, Tailored pH-triggered surfactant for stepwise separation of a three-component mineral systemi, Separation and Purification Technology, 316, 123753

  86. X.W. Peng, Q. Peng, M. Wu, W.D. Wang, Y.F. Gao, X. Liu, Y.X. Sun, D.L. Yang, Q.Y. Peng, T. Wang, X.Z. Chen, J.F. Liu, H. Zhang, H.B. Zeng, 2023, A pH and temperature dual-responsive microgel-embedded, adhesive and tough hydrogel for drug delivery and wound healing, ACS Applied Materials & Interfaces, 15, 19560-19573

  87. Y.M. Chen, F.C. Gong, W.J. Deng, H. Zhang, X.L. Wang, 2023, Dual-function electrolyte additive enabling simultaneous electrode interface and coordination environment regulation for zinc-ion batteries, Energy Storage Materials, 58, 20-29

  88. P.C. Li, H. Zhang, J. Lu, G. Li, 2023, Low concentration sulfolane-based electrolyte for high voltage lithium metal batteries, Angewandte Chemie, 62, e202216312

  89. A. Li, J. Chang , T. Shui , Q.X. Liu, H. Zhang, H.B. Zeng, 2023, Probing interaction forces associated with calcite scaling in aqueous solutions by atomic force microscopy, Journal of Colloid and Interface Science, 633, 764-774

  90. Z.W. Zhao, P.C. Li, Z.Q. Zhang, H. Zhang, G. Li, 2023, Dendrite-free zinc anode enabled by buffer-like additive via strong cationic specific absorption, Chemical Engineering Journal, 454, 140435

  91. X.Z. Zhang, Y. Li, H. Zhang, G. Li, 2023, Fast capture and stabilize Li-ions via physicochemical dual effects for ultra-stable self-supporting Li metal anode, Carbon Energy, e348

  92. G. Mahmud, H. Zhang, J.F. Douglas, 2022, The dynamics of metal nanoparticles on a supporting interacting substrate, Journal of Chemical Physics, 157, 114505

  93. M.F. Li, H. Zhang, Y.M. Zeng, J. Liu, 2022, A perspective on investigating transition metal high-entropy alloys for high-temperature applications, Acta Materialia, 240, 118313

  94. J.S. Chen, Q.Y. Peng, X.W. Peng, H. Zhang, H.B. Zeng, 2022, Probing and manipulating noncovalent interactions in functional polymeric systems, Chemical Reviews, 122, 14594-14678

  95. W.Y. Zhang, M.Y. Dong, K.R. Jiang, D.L.Yang, X.H. Tan, S.L. Zhai, R.F. Feng, N. Chen, G.King, H. Zhang, H.B.Zeng, H. Li, M. Antonietti, Z. Li, 2022, Self-repairing interphase reconstructed in each cycle for highly reversible aqueous zinc batteries, Nature Communications, 13, 5348

  96. M.F. Li, H. Zhang, Y.M. Zeng, J. Liu, 2022, Adsorption and dissociation of high-pressure hydrogen on Fe (100) and Fe2O3 (001) surfaces: Combining DFT calculation and statistical thermodynamics, Acta Materialia, 239, 118267

  97. G.C. Lv, C.L. Zhu, H. Zhang, Y. Su, P. Qian, 2022, Mechanism of CO2 adsorption on point-defective MgO surfaces: First-principles study, Applied Surface Science, 604, 154647

  98. D.L.Yang, X.W. Peng, Q.Y. Peng, T. Wang, C.Y. Qiao, Z.Q. Zhao, L. Gong, Y.L. Liu, H. Zhang, H.B. Zeng, 2022, Probing the interfacial forces and surface interaction mechanisms in petroleum production processes, Engineering, 18, 49-61

  99. Y.C. Yang, Q.L. Zhu, X.W. Peng, J.J. Sun, C. Li, X.M. Zhang, H. Zhang, J.B. Chen, X.F. Zhou, H.B. Zeng, Y.L. Zhang, 2022, Hydrogels for the removal of the methylene blue dye from wastewater: a reivew, Environmental Chemistry Letters, 20, 2665-2685

  100. A. Li, H. Zhang, Q.X. Liu, H.B. Zeng, 2022, Effects of chemical inhibitors on the scaling behaviors of calcite and the associated surface interaction mechanisms, Journal of Colloid and Interface Science, 618, 507-517

  101. X.W. Peng, W.D. Wang, W.S. Yang, J.S. Chen, Q.Y. Peng, T. Wang, D.L. Yang, J.M. Wang, H. Zhang, H.B. Zeng, 2022, Stretchable, compressible, and conductive hydrogel for sensitive wearable soft sensors, Journal of Colloid and Interface Science, 618, 111

  102. S.L. Zhai, X.R. Shi, K.R. Jiang, X.H. Tan, W.Y. Zhang, J.R. Zhang, H. Zhang, Z. Li, 2022, Flame normalizing-induced robust and oriented metallic layer for stable Zn anodei, Chemical Engineering Journal, 437, 135246

  103. Y.F. Gao, X.W. Peng, Q.Q. Wu, D.L. Yang, W.D. Wang, Q.Y. Peng, T. Wang, J.M. Wang, J.F. Liu, H. Zhang, H.B. Zeng, 2022, Hydrogen bonding-driven multi-functional polymer hydrogel networks based on tannic acid, ACS Applied Polymer Materials, 4, 1836

  104. X.H. Mao, Z.Q. Zhao, D.L. Yang, C.Y. Qiao, J.L. Tan, Q. Liu, T. Tang, H. Zhang, H.B. Zeng, 2021, Facile and scalable surface functionalization approach with small silane molecules for oil/water separation and demulsification of surfactant/asphaltenes-stabilized emulsions, Separation and Purification Technology, 285, 120382

  105. L.T. Gui, H. Zhang, Y. Zhao, Y.W. Wang, D.F. Chen, X.Y. Wang, G. Mahmud, M.J. Long, 2021, Effects of carbon segregation and interface roughness on the mobility of solid-liquid interface in Fe-C alloy: a molecular dynamics study, Materialia, 20, 101266

  106. X.Y. Wang, H. Zhang, J.F. Douglas, 2021, The initiation of shear band formation in deformed metallic glasses from soft localized domains, Journal of Chemical Physics, 155, 204504

  107. D.L. Yang, L. Xie, X.H. Mao, L. Gong, X.W. Peng, Q.Y. Peng, T. Wang, Q. Liu, H.B. Zeng, H. Zhang, 2021, Probing hydrophobic interactions between polymer surfaces and air bubbles or oil droplets: effects of molecular weight and surfactants, Langmuir, 38, 5257-5268

  108. M. Wu, F.F. Wang, J.S. Chen, H. Zhang, H.B. Zeng, J.F. Liu, 2021, Interactions of model airborne particulate matter with DPPC and a clinical surfactant calsurf, Journal of Colloid And Interface Science, 607, 1993-2009

  109. Q.Y. Peng, Q.Q. Wu, J.S. Chen, T. Wang, M. Wu, D.L. Yang, X.W. Peng, J.F. Liu, H. Zhang, H.B. Zeng, 2021, Coacervate-based Instant and Repeatable Underwater Adhesive with Anticancer and Antibacterial Properties, ACS Applied Materials & Interfaces, 13, 48239-48251

  110. L. Xie, J.Y. Wang, Q.Y. Lu, W.J.H. Hu, D.L. Yang, C.Y. Qiao, X.W. Peng, Q.Y. Peng, T. Wang, W. Sun, Q. Liu, H. Zhang, H.B. Zeng, 2021, Surface interaction mechanisms in mineral flotation: fundamentals, measurements, and perspectives, Advances in Colloid and Interface Science, 295, 102491

  111. X.Y. Sun, D.L. Yang, H. Zhang, H.B. Zeng, T. Tang, 2021, Unravelling the Interaction of Water-in-Oil Emulsion Droplets via Molecular Simulations and Surface Force Measurements, Journal of Physical Chemistry B, 125, 7556-7567

  112. X.H. Mao, D.L. Yang, L. Xie, Q. Liu, T. Tang, H. Zhang, H.B. Zeng, 2021, Probing the interactions between Pickering emulsion droplets stabilized with pH-responsive nanoparticles, Journal of Physical Chemistry B, 125, 7320-7331

  113. B. Xu, J. Huang, L.Y. Ding, H. Zhang, H.W. Zhang, 2021, A sensitive ammonia sensor using long period fiber grating coated with graphene oxide/cellulose acetate, IEEE Sensors Journal, 21, 16691

  114. Q.Y. Peng, J.S. Chen, T. Wang, L. Gong, X.W. Peng, M. Wu, Y.H. Ma, F.Y. Wu, D.L. Yang, H. Zhang, H.B. Zeng, 2021, Coacervation-driven instant paintable underwater adhesives with tunable optical and electrochromic properties, Journal of Materials Chemistry A, 9, 12988

  115. H. Zhang, X.Y. Wang, H.B. Yu, J.F. Douglas, 2021, Dynamic heterogeneity, cooperative motion, and Johari-Goldstein beta-relaxation in a metallic glass-forming material exhibiting a fragile to strong transition, European Physical Journal E, 44, 56

  116. H. Zhang, X.Y. Wang, H.B. Yu, J.F. Douglas, 2021, Fast dynamics in a model metallic glass-forming material, Journal of Chemical Physics, 154, 084505

  117. X.L. Hu, J.Y. Song, J.L. Luo, H. Zhang, Z.M. Sun, C.Q. Li, S.L. Zheng, Q.X. Liu, 2021, Single-atomic Pt sites anchored on defective TiO2 nanosheets as a superior photocatalyst for hydrogen evolution, Journal of Energy Chemistry, 62, 1-10

  118. H. Niazi, G. Nelson, L. Lamborn, R.L. Eadie, W.X. Chen, H. Zhang, 2021, Crack growth sensitivity to the magnitude and frequency of load fluctuation in stage 1b of high pH stress corrosion cracking, Corrosion, 77, 618

  119. C.Y. Qiao, D.L. Yang, X.H. Mao, L. Xie, L. Gong, X.W. Peng, Q.Y. Peng, T. Wang, H. Zhang, H.B. Zeng, 2021, Recent advances in bubble-based technologies: underlying interaction mechanisms and applications, Applied Physics Reviews, 8, 011315

  120. G. Mahmud, H. Zhang, J.F. Douglas, 2021, Localization model description of the interfacial dynamics of crystalline Cu and Cu64Zr36 metallic glass nanoparticles, European Physical Journal E, 44, 33

  121. L. Xie, X. Cui, J. Liu, Q.Y. Lu, J. Huang, X.H. Mao, D.L. Yang, J.L. Tan, H. Zhang, H.B. Zeng, 2021, Nanomechanical insights on versatile polydopamine wet adhesive interacting with liquid-infused and solid slippery surfaces, ACS Applied Materials & Interfaces, 13, 6941-6950

  122. H. Niazi, S.D. Wang, L. Lamborn, R.L. Eadie, W.X. Chen, H. Zhang, 2021, Effects of load interactions on the onset of stage two of high pH stress corrosion cracking, Journal of Pipeline Science and Engineering, 1, 122

  123. X. Xing, G.L. Deng, H. Zhang, G. Cui, J.G. Liu, Z.L. Li, B.Y. Wang, S.Q. Li, C. Qi, 2020, Molecular dynamics studies of hydrogen effect on intergranular fracture in alpha-iron, Materials, 13, 4949

  124. H. Niazi, R.L. Eadie, W.X. Chen, H. Zhang, 2020, High pH stress corrosion cracking initiation and crack evolution in buried steel pipelines: a review, Engineering Failure Analysis, 120, 105013

  125. P.X. Hao, X.Y.Wang, S.Li, H. Zhang, M.Khalkhal, Y.X. Shi, N.S. Cai, 2020, Warm hydrogen direct adsorptive separation and purification with highly CO/H2S-tolerant rare earth alloys, Applications in Energy and Combustion Science, 1-4, 100004

  126. D. Wang, D.L. Yang, C. Huang, Y.Y. Huang, D.Z. Yang, H. Zhang, Q. Liu, T. Tang, M.G. El-Din, T. Kemppi, B. Perdicakis, H.B. Zeng, 2020, Stabilization mechanism and chemical demulsification of water-in-oil and oil-in-water emulsions in petroleum industry: A review, Fuel, 286, 119390

  127. G. Mahmud, H. Zhang, J.F. Douglas, 2020, Localization model description of the interfacial dynamics of crystalline Cu and Cu64Zr36 metallic glass films, Journal of Chemical Physics, 153, 124508

  128. H. Niazi, K. Chevil, E. Gamboa, L. Lamborn, W.X. Chen, H. Zhang, 2020, Effects of loading spectra on high pH crack growth behavior of X65 pipeline steel, Corrosion, 76, 601

  129. L. Xie, D.L. Yang, Q.Y. Lu, H. Zhang, H.B. Zeng, 2020, Role of molecular architecture in the modulation of hydrophobic interactions, Current Opinion in Colloid & Interface Science, 47, 58

  130. M. Khalkhali, X.C. Zhu, Y.X. Shi, Q.X. Liu, P. Choi, H. Zhang, 2020, Structure and CO2 physisorption capacity of hydrotalcite-derived oxide, Journal of CO2 Utilization, 36, 64-75

  131. X.Y. Wang, W.S. Xu, H. Zhang, J.F. Douglas, 2019, Universal nature of dynamic heterogeneity in glass-forming liquids: A comparative study of metallic and polymeric glass-forming liquids, Journal of Chemical Physics, 151, 184503

  132. H. Zhang, X.Y. Wang, J.F. Douglas, 2019, Localization model description of diffusion and structural relaxation in superionic crystalline UO2, Journal of Chemical Physics, 151, 071101

  133. X. Xing, H. Zhang, G. Cui, J.G. Liu, Z.L. Li, 2019, Hydrogen inhibited phase transition near crack tip - an atomistic mechanism of hydrogen embrittlement, International Journal of Hydrogen Energy, 44, 17146-17153

  134. H. Zhang, X.Y. Wang, A. Chremos, J.F. Douglas, 2019, Superionic UO2: A Model Anharmonic Crystalline Material, Journal of Chemical Physics, 150, 174506

  135. M. Khalkhali, X.M. Ma, H. Zhang, Q.X. Liu, 2019, Bulk and surface properties of gypsum: A comparison between classical force fields and dispersion-corrected DFT calculations, Computational Materials Science, 164, 8-16

  136. X. Xing, J.Y. Zhou, S.X. Zhang, H. Zhang, Z.L. Li, Z.J. Li, 2019, Quantification of Temperature Dependence of Hydrogen Embrittlement in Pipeline Steel, Materials, 12, 585

  137. J.S. Chen, M. Wu, L. Gong, J.W Zhang, B. Yan, J.F. Liu, H. Zhang, T. Thundat, H.B. Zeng, 2019, Mechanistic understanding and nanomechanics of multiple hydrogen-bonding interaction in aqueous environment, Journal of Physical Chemistry C, 123, 4540-4548

  138. L.Y. Chen, Q.P. Cao, H. Zhang, X.D. Wang, D.X. Zhang, J.Z. Jiang, 2018, Surface compressive and softening effect on deformation mode transition in Ni-Nb metallic glassy thin films: A molecular dynamics studyi, Journal of Applied Physics, 124, 205304

  139. M.Z.Y. Gao, M. Khalkhali, S. Beck, P. Choi, H. Zhang, 2018, Study of Thermal Stability of Hydrotalcite and Carbon Dioxide Adsorption Behavior on Hydrotalcite-derived Mixed Oxides using Atomistic Simulations, ACS Omega, 3, 12041-12051

  140. L. Xie, J.Y. Wang, J. Huang, X. Cui, X.G. Wang, Q.X. Liu, H. Zhang, Q. Liu, H.B. Zeng, 2018, Anisotropic Polymer Adsorption on Molybdenite Basal and Edge Surfaces and Interaction Mechanism with Air Bubbles, Frontiers in Chemistry, 6, 361

  141. G.C. Lv, M. Zhang, H. Zhang, Y.J. Su, 2018, Hydrogen diffusion and vacancy clusterization in iron, International Journal of Hydrogen Energy, 43, 15378-15385

  142. S. Zhao, Y.W. Zhang, J.S. Fang, H. Zhang, Y.Y. Wang, Y.M. Zhou, W.X. Chen, C. Zhang, 2018, Self-assembled mesoporous carbon nitride with tunable texture for enhanced visible-light photocatalytic hydrogen evolution, ACS Sustainable Chemistry & Engineering, 6, 8291-8299

  143. Z. Khorshidi, M. Khalkhali, H. Zhang, P. Choi, 2018, Molecular dynamics study of the role of water in the carbon dioxide intercalation in chloride ions bearing hydrotalcite, Journal of Physical Chemistry C, 122, 9507-9514

  144. M. Khalkhali, H. Zhang, Q.X. Liu, 2018, Effects of thickness and adsorption of airborne hydrocarbons on wetting properties of MoS2: an atomistic simulation study, Journal of Physical Chemistry C, 122, 6737-6747

  145. J.J. Bian, H. Zhang, X.R. Niu, G.G. Wang, 2018, Anisotropic deformation in the compressions of single crystalline copper nanoparticles, Crystals, 8, 116

  146. D.W. Yuan, L. Xie, X.W. Shi, L.S. Yi, G.F. Zhang, H. Zhang, Q. Liu, H.B. Zeng, 2018, Selective flotation of molybdenite and talc by humic substance, Minerals Engineering, 117, 34-41

  147. X.Y. Wang, X.H. Tong, H. Zhang, J.F. Douglas, 2017, String-like collective motion and diffusion in the interfacial region of ice, Journal of Chemical Physics, 147, 194508

  148. T.D. Xu, X.D. Wang, H. Zhang, Q.P. Cao, D.X. Zhang, J.Z. Jiang, 2017, Structural evolution and atomic dynamics in Ni-Nb metallic glasses: a molecular dynamics study, Journal of Chemical Physics, 147, 144503

  149. J.Y. Wang, L. Xie, H. Zhang, Q. Liu, Q.X. Liu, H.B. Zeng, 2017, Probing interactions between sphalerite and hydrophobic/hydrophilic surfaces: effect of water chemistry, Powder Technology, 320, 511

  150. W.B. Zhang, J. Liu, S.H. Lu, H. Zhang, H. Wang, X.D. Wang, Q.P. Cao, D.X. Zhang, J.Z. Jiang, 2017, Size effect on atomic structure in low-dimensional Cu-Zr amorphous systems, Scientific Reports, 7, 7291

  151. M. Khalkhali, N. Kazemi, H. Zhang, Q.X. Liu, 2017, Wetting at the Nanoscale: A Molecular Dynamics Study, Journal of Chemical Physics, 146, 114704

  152. L. Xie, J.Y. Wang, C. Shi, X. Cui, J. Huang, H. Zhang, Q. Liu, Q.X. Liu, H.B. Zeng, 2017, Mapping nanoscale heterogeneity of surface hydrophobicity on sphalerite mineral, Journal of Physical Chemistry C, 121, 5620

  153. L. Xie, J.Y. Wang, D.W. Yuan, C. Shi, X. Cui, H. Zhang, Q. Liu, Q.X. Liu, H.B. Zeng, 2017, Interaction mechanisms between air bubble and molybdenite surface: impact of solution salinity and polymer adsorption, Langmuir, 33, 2353

  154. L.H. Xiong, X.D. Wang, Q. Yu, H. Zhang, F. Zhang, Y. Sun, Q.P. Cao, H.L. Xie, T.Q. Xiao, D.X. Zhang, C.Z. Wang, K.M. Ho, Y. Ren, J.Z. Jiang, 2017, Temperature-dependent structure evolution in liquid gallium, Acta Materialia, 128, 304

  155. X. Xing, W.X. Chen, H. Zhang, 2017, Atomistic study of hydrogen embrittlement during cyclic loading: quantitative model of hydrogen accumulation effects, International Journal of Hydrogen Energy, 42, 4571

  156. E.J. Haddadian, H. Zhang, K.F. Freed, J.F. Douglas, 2017, Comparative Study of the Collective Dynamics of Proteins and Inorganic Nanoparticles, Scientific Reports, 7, 41671

  157. X. Xing, M.S. Yu, W.X. Chen, H. Zhang, 2017, Atomistic simulation of hydrogen-assisted ductile-to-brittle transition in alpha-Fe, Computational Materials Science, 127, 211

  158. X.H. Tong, P. Choi, S. Li, Y.X. Shi, H. Zhang, 2016 Molecular Dynamics Study on Structure Evolution of Monocarboxylic Acids Intercalated Layered Double Hydroxide, RSC Advances, 6, 98804

  159. L. Xie, J.Y. Wang, C. Shi, J. Huang, H. Zhang, Q. Liu, Q.X. Liu, H.B. Zeng, 2016, Probing Surface Interactions of Electrochemically Active Galena Mineral Surface Using Atomic Force Microscope, Journal of Physical Chemistry C, 120, 22433

  160. Q. Liu, X. Lu, L. Li, H. Zhang, G.Y. Liu, H. Zhong, H.B. Zeng, 2016, Probing the Reversible Fe3+-DOPA Mediated Bridging Interaction in Mussel Foot Protein-1, Journal of Physical Chemistry C, 120, 21670

  161. P.P. Gao, Q. Wu, X. Li, H.X. Ma, H. Zhang, A. Volinsky, L.J. Qiao, Y.J. Su, 2016, Size-dependent concentration of thermal vacancies in solid films, Physical Chemistry Chemical Physics, 18, 22661

  162. C. Zhong, H. Zhang, Q.P. Cao, X.D. Wang, D.X. Zhang, U. Ramamurty, J.Z. Jiang, 2016, Deformation behavior of metallic glasses with shear band like atomic structure: a molecular dynamics study, Scientific Reports, 6, 30935

  163. C. Zhong, H. Zhang, Q.P. Cao, X.D. Wang, D.X. Zhang, U. Ramamurty, J.Z. Jiang, 2016, Size distribution of shear transformation zones and their evolution towards the formation of shear bands in metallic glasses, Journal of Non-Crystalline Solids, 445-446, 61

  164. B. Liu, H. Zhang, J.Y. Tao, Z.R. Liu, X. Chen, Y.A. Zhang, 2016, Development of a second-nearest-neighbor modified embedded atom method potential for silicon-phosphorus binary system, Computational Materials Science, 120, 1

  165. G.C. Lv , H. Zhang , X.F. He , W. Yang , Y.J. Su, 2016, Vacancy enhanced formation and phase transition of Cu-rich precipitates in alpha-iron under neutron irradiation, AIP Advances, 6, 045004

  166. C. Zhong, H. Zhang, Q.P. Cao, X.D. Wang, D.X. Zhang, P.K. Liaw, J.Z. Jiang, 2016, Non-localized deformation in Cu-Zr multi-layer amorphous films under tension, Journal of Alloys and Compounds, 678, 410

  167. J.F. Douglas, B.A. Pazmino Betancourt, Xuhang Tong, H. Zhang, 2016, Localization model description of diffusion and structural relaxation in glass-forming Cu-Zr alloys, Journal of Statistical Mechanics: Theory and Experiment, 2016, 054048

  168. M. Khalkhali, H.B. Zeng, Q.X. Liu, H. Zhang, 2016, Structural evolutions of ZnS nanoparticles in hydrated and bare states, Journal of Physical Chemistry C, 120, 7870

  169. Z.J. Yao, H. Zhang, Y.L. Hu, J.J. Bian G.F. Wang, J. Lu, X.R. Niu, 2016, Ultrasound driven aggregation - a novel method to assemble ceramic nanoparticles, Extreme Mechanics Letters, 7, 71

  170. C. Zhong, H. Zhang, Q.P. Cao, X.D. Wang, D.X. Zhang, U. Ramamurty, J.Z. Jiang, 2016, On the critical thickness for non-localized to localized plastic flow transition in metallic glasses: a molecular dynamics study, Scripta Materialia, 114, 93

  171. M. Khalkhali, Q.X. Liu, H.B. Zeng, H. Zhang, 2015, A size-dependent structural evolution of ZnS nanoparticles, Scientific Reports, 5, 14267

  172. B. Liu, H. Zhang, J.Y. Tao, X. Chen, Y.A. Zhang, 2015, Comparative investigation of a newly optimized modified embedded atom method potential with other potentials for silicon, Computational Materials Science, 109, 277

  173. L. Yang, J.J. Bian, H. Zhang, X.R. Niu, G.F. Wang, 2015, Size-dependent deformation mechanisms in hollow silicon nanoparticles, AIP Advances, 5, 077162

  174. M.S. Yu, X. Xing, H. Zhang, J.X. Zhao, R. Eadie, W.X. Chen, J. Been, G. Van Boven, R. Kania, 2015, Corrosion fatigue crack growth behaviour of pipeline steel under underload type variable amplitude loading schemes, Acta Materialia, 96, 159

  175. H. Zhang, C. Zhong, J.F. Douglas, X.D. Wang, Q.P. Cao, D.X. Zhang, J.Z. Jiang, 2015, Role of string-like collective atomic motion on diffusion and structural relaxation in glass forming Cu-Zr alloys, Journal of Chemical Physics, 142, 164506

  176. X. Xing, W.X. Chen, H. Zhang, 2015, Prediction of crack propagation under cyclic loading based on hydrogen diffusion, Materials Letters, 152, 86

  177. X.D. Wang, S. Aryal, C. Zhong, W.Y. Ching, H.W. Sheng, H. Zhang, D.X. Zhang, Q.P. Cao, J.Z. Jiang, 2015, Atomic picture of elastic deformation in a metallic glass, Scientific Reports, 5, 9184

  178. H. Zhang, Y. Yang, J.F. Douglas, 2015, Influence of string-like cooperative atomic motion on surface diffusion in the (110) interfacial region of crystalline Ni, Journal of Chemical Physics, 142, 084704.

  179. X.H. Tong, H. Zhang, D.Y. Li, 2015, Effect of annealing treatment on mechanical properties of nanocrystalline alpha-iron: an atomistic study, Scientific Reports, 5, 8459

  180. G.C. Lv, H. Zhang, X.F. He, W. Yang, Y.J. Su, 2015, Atomistic simulation of Cu-Ni precipitates hardening in alpha-iron, Journal of Physics D: Applied Physics, 48, 115302

  181. C. Zhong, H. Zhang, Q.P. Cao, X.D. Wang, D.X. Zhang, J.Z. Jiang, 2015, The size-dependent non-localized deformation in a metallic alloy, Scripta Materialia , 101, 48

  182. M. Khalkhali, Q.X. Liu, H. Zhang, 2014, A comparison of different empirical potentials in ZnS, Modelling and Simulation in Materials Science and Engineering, 22, 085014

  183. X.H. Tong, H. Zhang, D.Y. Li, 2014, Effects of misorientation and inclination on mechanical response of <110> tilt grain boundaries in alpha-Fe to external stresses, Modelling and Simulation in Materials Science and Engineering, 22, 065016

  184. Y. Yang, H. Zhang, J.F. Douglas, 2014, Origin and nature of spontaneous shape fluctuations in 'small' nanoparticles, ACS Nano, 8, 7465-7477

  185. J.J. Bian, X.R. Niu, H. Zhang, G.F. Wang, 2014, Atomistic deformation mechanisms in twinned copper nanospheres, Nanoscale Research Letters, 9, 335.

  186. D.H. Kang, H. Zhang, H. Yoo, H.H. Lee, S. Lee, G.W. Lee, H.B. Lou, X.D. Wang, Q.P. Cao, D.X. Zhang, J.Z. Jiang, 2014, Interfacial free energy controlling glass-forming ability of Cu-Zr alloys, Scientific Reports, 4, 5167.

  187. W.W. Li, G.Q. Liu, H. Wang, H. Zhang, J.H. Luan, A. Ullah, 2013, Topological correlations of grain faces in polycrystal with experimental verification, Europhysics Letters, 104, 56006.

  188. D. Zhu, H. Zhang, D.Y. Li, 2013, Effects of nano-scale grain boundaries in Cu on its Bauschinger's effect and response to cyclic deformation, Materials Science & Engineering A, 583, 140-150.

  189. C. He, Q.R. Gu, H.B. Zeng, H. Zhang, M. Huang, X.Y. Yang, J. Xing, J. Chen, 2013, Microbubble-enhanced cell membrane permeability in high gravity field, Cellular and Molecular Bioengineering, 6, 266-278.

  190. D. Zhu, H. Zhang, D.Y. Li, 2013, Influence of nanotwin boundary on the Bauschinger's effect in Cu - A molecular dynamics simulation study, Metallurgical and Materials Transactions A, 44, 4207-4217.

  191. H. Zhang, J.F. Douglas, 2013, Glassy interfacial dynamics of Ni nanoparticles: Part I colored noise, dynamic heterogeneity and collective atomic motion, Soft Matter, 9, 1254-1265.

  192. H. Zhang, J.F. Douglas, 2013, Glassy interfacial dynamics of Ni nanoparticles: Part II discrete breathers as an explanation of two-level energy fluctuations, Soft Matter, 9, 1266-1280.

  193. H. Zhang, M. Khalkhali, Q.X. Liu, J.F. Douglas, 2013, String-like cooperative motion in homogeneous melting, Journal of Chemical Physics, 138, 12A538.

  194. A. Marchenko, H. Zhang, 2012, Effects of location of twin boundaries and grain size on plastic deformation of nanocrystalline copper, Metallurgical and Materials Transactions A, 43, 3547-3555.

  195. K. Prashanthi, H. Zhang, V. Ramgopal Rao, T. Thundat, 2012, Local piezoelectric response of ZnO nanoparticles embedded in a photosensitive polymer, Physica Status Solidi (PRL) - Rapid Researcvh Letters, 6, 77-79.

  196. D. Zhu, H. Zhang, D.Y. Li, 2011, Molecular dynamics simulation of Bauschinger's effect in copper single crystal during cyclic loading within different strain ranges, Journal of Applied Physics, 110, 124911.

  197. X. Y. Liu, W. B. Xie, W. X. Chen, H. Zhang, 2011, Effects of grain boundary and boundary inclination on hydrogen diffusion in alpha-iron, Journal of Materials Research, 26, 2735-2743.

  198. Y. Liu, Z. P. Zhu, G. Y. Liu, Z. H. Xu, S. M. Kuznicki, H. Zhang, 2011, A Novel Method to Improve Crystallinity of Supported Nanoparticles using Low Melting Point Metals, Journal of Physical Chemistry C, 115, 14591.

  199. W. B. Xie, X. Y. Liu, W. X. Chen, H. Zhang, 2011, Hydrogen Hardening Effect in Heavily Deformed Single Crystal alpha-Fe, Computational Materials Science, 50, 3397-3402.

  200. H. Zhang, P. Kalvapalle, J. F. Douglas, 2011, String-Like Collective Atomic Motion in the Melting and Freezing of Nanoparticles, Journal of Physical Chemistry B, 115, 14068-14076.

  201. X. Y. Liu, E. Luber, D. Mitlin, H. Zhang, 2011, Design of High Tg Zr-based Metallic Glasses using Atomistic Simulation and Experiment, Philosophical Magazine, 91, 3393-3405.

  202. H. Zhang, P. Kalvapalle, J.F. Douglas, 2010, String-like Collective Atomic Motion in the Interfacial Dynamics of Nanoparticles, Soft Matter, 6, 5944-5955.

  203. L. Yue, H. Zhang, D.Y. Li, 2010, Defect generation in nano-twinned, nano-grained and single-crystal Cu systems caused by wear - a molecular dynamics study, Scripta Materialia, 63, 1116-1119.

  204. X. Yan, H. Zhang, 2010, On the Atomistic Mechanisms of Grain Boundary Migration in [001] Twist Boundaries: Molecular Dynamics Simulations, Computational Materials Science, 48, 773-782.

  205. L. Yue, H. Zhang, D.Y. Li, 2010, A closer look at the local responses of twin and grain boundaries in Cu to stress at nano-scale with possible transition from the P-H relation to inverse P-H one, Acta Materialia, 58, 2677-2684.

  206. A. Gerlich, L. Yue, P.F. Mendez, H. Zhang, 2010, Plastic Deformation of Nanocrystalline Aluminum at High Temperatures and Strain Rate, Acta Materialia, 58, 2176-2185.

  207. H. Zhang, 2009, Atomistic Simulation of Sliding of [10-10] Tilt Grain Boundaries in Mg, Journal of Materials Research, 24, 3446-3453.

  208. H. Zhang, D. J. Srolovitz, J. F. Douglas, J. A. Warren, 2009, Grain Boundaries Exhibit the Dynamics of Glass-Forming Liquids, Proceedings of the National Academy of Sciences of the United States of America, 106, 7729-7734. Featured in Editor's Choice, Science, 2009, 324, 858.

    209. Press coverage

  209. H. Zhang, D. Du, D. J. Srolovitz, 2008, Effects of Boundary Inclination and Boundary Type on Shear-Driven Grain Boundary Migrationi, Philosophical Magazine, 88, 243-256.

  210. H. Zhang, D. J. Srolovitz, J. F. Douglas, J. A. Warren, 2007, Atomic Motion during the Migration of General [001] Tilt Grain Boundaries in Ni, Acta Materialia, 55, 4527-4533.

  211. D. Du, H. Zhang, D.J. Srolovitz, 2007, Properties and Determination of the Interface Stiffness, Acta Materialia, 55, 467-471.

  212. H. Zhang, D. J. Srolovitz, J. F. Douglas, J. A. Warren, 2006, Characterization of Atomic Motions Governing Grain Boundary Migration, Physical Review B, 74,115404; also selected in Virtual Journal of Nanoscale Science and Technology, 14, 13.

  213. H. Zhang, M. I. Mendelev, D. Du, D. J. Srolovitz, 2006, Determination of Grain Boundary Stiffness from Molecular Dynamics Simulation, Applied Physics Letters, 88, 121927.

  214. H. Zhang, D. J. Srolovitz, 2006, Simulation and Analysis of the Migration Mechanism of Sigma5 Tilt Grain Boundaries in an FCC Metal, Acta Materialia, 54, 623-633.

  215. K. Barmak, J. Kim, C.-S. Kim, W. E. Archibald, G. R. Rohrer, A. D. Rollett, D. Kinderlehrer, S. Ta’asan, H. Zhang, D. J. Srolovitz, 2006, Grain Boundary Energy and Grain Growth in Al Films: Comparison of Experiments and Simulations, Scripta Materialia, 54, 1059-1063.

  216. L. Zhou, H. Zhang, D. J. Srolovitz, 2005, A Size Effect in Grain Boundary Migration: A Molecular Dynamics Study of Bicrystal Thin Films, Acta Materialia, 53, 5273-5279.

  217. H. Zhang, M. I. Mendelev, D. J. Srolovitz, 2005, Mobility of Sigma 5 Tilt Grain Boundaries: Inclination Dependence, Scripta Materialia, 52, 1193-1198.

  218. M. I. Mendelev, H. Zhang and D. J. Srolovitz, 2005, Grain Boundary Self-diffusion in Ni: effect of boundary inclination, Journal of Materials Research, 20, 1146-1153.

  219. H. Zhang, M. Upmanyu, D. J. Srolovitz, 2005, Curvature Driven Grain Boundary Migration in Aluminum: Molecular Dynamics Simulations, Acta Materialia, 53, 79-86.

  220. H. Zhang, M. I. Mendelev and D. J. Srolovitz, 2004, Computer Simulation of the Elastically-Driven Migration of a Flat Grain Boundary, Acta Materialia, 52, 2569-2576.

  221. H. Zhang, Z. N. Xia, 2000, Molecular Dynamics Simulation of Cluster Beam Al Depositing on Si (100) Substrate, Nuclear Instruments & Methods in Physics Research Section B - Beam Interactions with Materials and Atoms, 160, 372-376.

  222. L. He, Z.N. Xia, H. Zhang, J. Y. Feng, Y. W. Lu, 1998, Deposition of an energetic Al Cluster on Si (111) Substrate: A Molecular Dynamic Simulation, Modelling and Simulation in Materials Science and Engineering, 6, 709-716.

    223. Book Chapters

  223. H. Zhang, J.F. Douglas, Similarities of the Collective Interfacial Dynamics of Grain Boundaries and Nanoparticles to Glass-Forming Liquids; Advances in Chemical Physics, Vol. 152, Liquid Polymorphism, H.E. Stanley, March 2013.