(*Corresponding author; Equal contribution)

  1. Y Hong, Y Wu, S Wu, X Wang, J Zhang*, “Overview of Computational Simulations in Quantum Dots”, Israel Journal of Chemistry,, 2019 pdf, Endnote
  2. Z Zhang, Y Hong, B Hou, Z Zhang, M Negahban, J Zhang*, “Accelerated Discoveries of Mechanical Properties of Graphene Using Machine Learning and High-Throughput Computation”, Carbon, 148. 115-123, 2019 pdf, Endnote
  3. X Wang, Y Hong, M Wang, G Xin, Y Yue, J Zhang*, “Mechanical Properties of Molybdenum Diselenide Revealed by Molecular Dynamics Simulation and Support Vector Machine”, Physical Chemistry Chemical Physics, 10.1039/C8CP07881E, 2019 In Print
  4. Y Xiong, H Wu, J Gao, W Chen, J Zhang*, Y Yue*, “Toward Improved Thermal Conductance of Graphene-Polyethylene Composites via Surface Defect Engineering: A Molecular Dynamics Study”, Acta Physico-Chimica Sinica, 2019 pdf, Endnote
  5. Y Hong, J Zhang, C Zhu*, XC Zeng*, J Francisco, “Water Desalination through Rim Functionalized Carbon NanotubesCover Article, Journal of Materials Chemistry A, 7, 3583-3591, 2019 pdf, Endnote
  6. D Han, X Wang*, W Ding, Y Chen, J Zhang, G Xin, L Cheng*, “Phonon thermal conduction in a graphene-C3N heterobilayer using molecular dynamics simulations”, Nanotechnology, 30, 075403, 2018 pdf, Endnote
  7. Y Hong, Z Zhang, J Zhang*, XC Zeng*, “Machine Learning and Artificial Neural Network Prediction of Interfacial Thermal Resistance between Graphene and Hexagonal Boron Nitride”, Nanoscale, 10, 19092-19099, 2018 pdf, Endnote
  8. M Han, Y Xie, J Liu, J Zhang, X Wang*, “Significantly Reduced c-axis Thermal Diffusivity of Graphene-based Papers”, Nanotechnology, 29, 265702, 2018 pdf, Endnote
  9. Y Hong, J Zhang*, XC Zeng*, “Monolayer and Bilayer Polyaniline C3N: Two-Dimensional Semiconductors with High Thermal Conductivity”, 2018 Nanoscale Top 25 Most Popular Articles Nanoscale, 10, 4301-4310, 2018 pdf, Endnote
  10. Y Hong, M Ju, J Zhang*, XC Zeng*, “Phonon Thermal Transport in Graphene/MoSe2 van der Waals Heterobilayer”, Physical Chemistry Chemical Physics, 20, 2637-2645, 2018 pdf, Endnote
  11. C Li, J Zhang, Q Xiong, G Lorenzini, Y Yue*, “pH Effect on Thermal Response of Fluorescence Spectroscopy of Graphene Quantum Dots for Nanoscale Thermal Characterization”, Journal of Engineering Thermophysics, 27, 345-356, 2018 pdf, Endnote
  12. Y Hong, J Zhang*, XC Zeng*, “Thermal Transport in Phosphorene and Phosphorene-Based Materials: A Review on Numerical Studies”, Chinese Physics B, 27, 036501, 2018 pdf, Endnote
  13. D Liao, W Chen, J Zhang, Y Yue*, “Tuning Thermal Conductance of CNT Interface Junction via Stretching and Atomic Bonding”, Journal of Physics D: Applied Physics, 50, 475302, 2017 pdf, Endnote
  14. X Wang, M Wang, Y Hong, Z Wang, J Zhang*, “Coherent and Incoherent Phonon Transport in Graphene and Nitrogenated Holey Graphene Superlattice”, Physical Chemistry Chemical Physics, 19, 24240-24248, 2017 pdf, Endnote
  15. X Wang, Y Hong, P K L Chan, J Zhang*, “Phonon Thermal Transport in Silicene-Germanene Superlattice: A Molecular Dynamics Study”, Nanotechnology, 28, 255403, 2017 pdf, Endnote
  16. X Wang, J Zhang, Y Chen, P K L Chan*, “Investigation of interfacial thermal transport across graphene and an organic semiconductor using molecular dynamics simulations”, Physical Chemistry Chemical Physics, 19, 15933-15941, 2017 pdf, Endnote
  17. X Wang, Y Hong, D Ma, J Zhang*, “Molecular Dynamics Study of Thermal Transport in Nitrogenated Holey Graphene Bilayer”, Journal of Materials Chemistry C, 5, 5119-5127, 2017 pdf, Endnote
  18. J Zhang*, Y Hong, X Wang, Y Yue*, D Xie, J Jiang, Y Xiong, P Li, “Phonon Thermal Properties of Transition-Metal Dichalcogenides MoS2 and MoSe2 Heterostructure”, The Journal of Physical Chemistry C, 121(19), 10336–10344, 2017 pdf, Endnote
  19. Y Yue*, J Zhang, Y Xie, W Chen, X Wang*, “Energy Coupling across Low-dimensional Contact Interfaces at the Atomic Scale”, International Journal of Heat and Mass Transfer, 110, 827–844, 2017 pdf, Endnote
  20. Q Xiong, Y Yang, F Xu, Y Pan, J Zhang, K Hong*, G Lorenzini*, S Wang*, “Overview of Computational Fluid Dynamics Simulation of Reactor-Scale Biomass Pyrolysis”, ACS Sustainable Chemistry & Engineering, 5(4), 2783–2798, 2017 pdf, Endnote
  21. X Wang, J Zhang, Y Chen*, P Chan*, “Molecular dynamics study of thermal transport in dinaphtho[2,3-b:2’,3’-f]thieno[3,2-b]thiophene (DNTT) organic semiconductor”, Nanoscale, 9, 2262-2271, 2017 pdf, Endnote
  22. J Zhang*, X Wang, Y Hong, Q Xiong, J Jiang, Y Yue*, “Understanding thermal transport in asymmetric layer hexagonal boron nitride heterostructure”, Nanotechnology 28, 035404, 2017 pdf, Endnote
  23. Y Hong, C Zhu, M Ju, J Zhang*, XC Zeng*, “Lateral and Flexural Phonon Thermal Transport in Graphene and Stanene Bilayer”, Physical Chemistry Chemical Physics, 19, 6554-6562, 2017 pdf, Endnote
  24. J Zhang, Y Hong, M Liu, Y Yue, Q Xiong*, G Lorenzini*, “Molecular dynamics simulation of the interfacial thermal resistance between phosphorene and silicon substrate”, International Journal of Heat and Mass Transfer 104, 87-877, 2017 pdf, Endnote
  25. Y Hong, J Zhang* and XC Zeng*, “Interlayer thermal conductance within a phosphorene and graphene bilayer”, Nanoscale, 8, 19211-19218, 2016 pdf, Endnote
  26. Y Hong, J Zhang*, XC Zeng*, “Thermal Conductivity of Monolayer MoSe2 and MoS2”, The Journal of Physical Chemistry C, 120 (45), 26067–26075, 2016 pdf, Endnote
  27. W Chen, J Zhang*, Y Yue*, “Molecular dynamics study on thermal transport at carbon nanotube interface junctions: Effects of mechanical force and chemical functionalization”, International Journal of Heat and Mass Transfer 103, 1058–1064, 2016 pdf, Endnote
  28. Y Hong, J Zhang* and XC Zeng*, “Thermal contact resistance across a linear heterojunction within a hybrid graphene/hexagonal boron nitride sheet”, Physical Chemistry Chemical Physics, 18, 24164-24170, 2016 pdf, Endnote
  29. Q Xiong*, J Zhang, F Xu, G Wiggins, CS Daw*, “Coupling DAEM and CFD for simulatingbiomass fast pyrolysis in fluidized beds”, Journal of Analytical and Applied Pyrolysis 117, 176–181,1,2016 pdf, Endnote
  30. Y Yue, J Zhang, X Tang, S Xu, X Wang*, “Thermal transport across atomic-layer material interfaces”, Nanotechnology Reviews 4 (6), 533–555, 1, 2015 pdf, Endnote
  31. Y Hong, J Zhang*, X Huang, XC Zeng*, “Thermal conductivity of a two-dimensional phosphorene sheet: a comparative study with graphene”, Nanoscale 7, 18716-18724, 3, 2015 pdf, Endnote
  32. J Zhang, Y Hong, Z Tong, Z Xiao*, H Bao, Y Yue*, “Molecular Dynamics Study of Interfacial Thermal Transport between Silicene and SubstrateBack Cover Article, Physical Chemistry Chemical Physics 17, 23704-23710, 2, 2015 pdf, Endnote
  33. J Zhang*, Y Hong, Y Yue*, “Thermal transport across graphene and single layer hexagonal boron nitride”, Journal of Applied Physics 117 (13), 134307, 8, 2015 pdf, Endnote
  34. M Li, J Zhang, X Hu, Y Yue*, “Thermal transport across graphene/SiC interface: effects of atomic bond and crystallinity of substrate”, Applied Physics A 119 (2), 415-424, 3, 2015 pdf, Endnote
  35. J Zhang, F Xu, Y Hong, Q Xiong*, J Pan*, “A comprehensive review on the molecular dynamics simulation of the novel thermal properties of graphene”, RSC Advances 5, 89415-89426, 2015 pdf, Endnote
  36. Y Hong, L Lei, XC Zeng*, J Zhang*, “Tuning thermal contact conductance at graphene-copper interface via surface nanoengineering”, 2015 Hot Papers in Nanoscale Nanoscale 7, 6286-6294, 8, 2015 pdf, Endnote
  37. X Tang, S Xu, J Zhang, X Wang*, “Five orders of magnitude reduction in energy coupling across corrugated graphene/substrate interfaces”, ACS Applied Materials & Interfaces 6 (4), 2809-2818, 6, 2014 pdf, Endnote
  38. J Zhang, X Wang*, H Xie, “Co-existing heat currents in opposite directions in graphene nanoribbons”, Physics Letters A 377 (41), 2970-2978, 6, 2013 pdf, Endnote
  39. C Li, J Zhang, X Wang*, “Phase change and stress wave in picosecond laser–material interaction with shock wave formation”, Applied Physics A 112 (3), 677-687, 8, 2013 pdf, Endnote
  40. J Zhang, X Wang*, H Xie, “Phonon energy inversion in graphene during transient thermal transport”, Physics Letters A 377 (9), 721-726, 8, 2013 pdf, Endnote
  41. J Zhang, X Wang*, “Thermal transport in bent graphene nanoribbons”, Nanoscale 5 (2), 734-743, 15, 2013 pdf, Endnote
  42. J Zhang, Y Wang, X Wang*, “Rough contact is not always bad for interfacial energy coupling”, Nanoscale 5 (23), 11598-11603, 12, 2013 pdf, Endnote
  43. Y Yue, J Zhang, X Wang*, “Micro/Nanoscale Spatial Resolution Temperature Probing for the Interfacial Thermal Characterization of Epitaxial Graphene on 4H‐SiC”, Small 7 (23), 3324-3333, 37, 2011 pdf, Endnote
  44. J Zhang, X Huang, Y Yue, J Wang, X Wang*, “Dynamic response of graphene to thermal impulse”, Physical Review B 84 (23), 235416, 24, 2011 pdf, Endnote