All Stories

  1. Janus graphene: A two-dimensional half-auxetic carbon allotrope with a nonchemical Janus configuration

    Article • March 2024, American Physical Society (APS)

    Mr Guangzhao Qin

  2. Biaxial strain modulated electronic structures of layered two-dimensional MoSiGeN4 Rashba systems

    Article • Physical Chemistry Chemical Physics, January 2024, Royal Society of Chemistry

    Mr Guangzhao Qin

  3. Alloying enhanced negative Poisson's ratio in two-dimensional aluminum gallium nitride (AlxGa1−xN)

    Article • Physical Chemistry Chemical Physics, January 2024, Royal Society of Chemistry

    Mr Guangzhao Qin

  4. Alloying Reversed Anisotropy of Thermal Transport in Bulk Al0.5Ga0.5N

    Article • The Journal of Physical Chemistry Letters, October 2023, American Chemical Society (ACS)

    Mr Guangzhao Qin

  5. Effect of Nanoscale in Situ Interface Welding on the Macroscale Thermal Conductivity of Insulating Epoxy Composites: A Multiscale Simulation Investigation

    Article • ACS Nano, September 2023, American Chemical Society (ACS)

    Mr Guangzhao Qin

  6. Inverse Janus design of two-dimensional Rashba semiconductors

    Article • September 2023, American Physical Society (APS)

    Mr Guangzhao Qin

  7. Ultra-high thermal conductivity of two-dimensional C23

    Article • Nanotechnology, February 2023, Institute of Physics Publishing

    Mr Guangzhao Qin

  8. Unexpected Enhanced Thermal Conductivity of GaxIn1–xSb Ternary Alloys

    Article • The Journal of Physical Chemistry C, January 2023, American Chemical Society (ACS)

    Mr Guangzhao Qin

  9. Efficient modulation of thermal transport in two-dimensional materials for thermal management in device applications

    Article • Nanoscale, January 2023, Royal Society of Chemistry

    Mr Guangzhao Qin

  10. Predicting lattice thermal conductivity from fundamental material properties using machine learning techniques

    Article • Journal of Materials Chemistry A, January 2023, Royal Society of Chemistry

    Mr Guangzhao Qin

  11. Activated Lone-Pair Electrons Lead to Low Lattice Thermal Conductivity: A Case Study of Boron Arsenide

    Article • The Journal of Physical Chemistry Letters, December 2022, American Chemical Society (ACS)

    Mr Guangzhao Qin

  12. Anisotropic Optical, Mechanical, and Thermoelectric Properties of Two-Dimensional Fullerene Networks

    Article • The Journal of Physical Chemistry Letters, December 2022, American Chemical Society (ACS)

    Mr Guangzhao Qin

  13. Thermal conductivity of ethylene glycol and water binary mixtures at evaluated temperature and pressure

    Article • The Journal of Chemical Thermodynamics, December 2022, Elsevier

    Mr Guangzhao Qin

  14. Enhanced optical absorption and solar steam generation of CB-ATO hybrid nanofluids

    Article • Renewable Energy, November 2022, Elsevier

    Mr Guangzhao Qin

  15. Multifunctional two-dimensional graphene-like boron nitride allotrope of g-B3N5: A competitor to g-BN?

    Article • Journal of Alloys and Compounds, November 2022, Elsevier

    Mr Guangzhao Qin

  16. N-doped graphene film prepared by rapid thermal shock for ultra-sensitive temperature reading

    Article • Applied Surface Science, October 2022, Elsevier

    Mr Guangzhao Qin

  17. Softened sp2−sp

    Article • September 2022, American Physical Society (APS)

    Mr Guangzhao Qin

  18. Experimental measurement and prediction of thermal conductivity of fatty acid ethyl esters: ethyl butyrate and ethyl caproate

    Article • Fluid Phase Equilibria, September 2022, Elsevier

    Mr Guangzhao Qin

  19. Erratum: Hydrodynamically enhanced thermal transport due to strong interlayer interactions: A case study of strained bilayer graphene [Phys. Rev. B 105, 125406 (2022)]

    Article • August 2022, American Physical Society (APS)

    Mr Guangzhao Qin

  20. Thermally conductive silicone rubber composites with vertically oriented carbon fibers: A new perspective on the heat conduction mechanism

    Article • Chemical Engineering Journal, August 2022, Elsevier

    Mr Guangzhao Qin

  21. Enhancing thermal conductivity of silicone rubber composites by in-situ constructing SiC networks: A finite-element study based on first principles calculation

    Article • Nano Research, July 2022, Tsinghua University Press

    Mr Guangzhao Qin

  22. Thermal conductivity of polydisperse hexagonal BN/polyimide composites: Iterative EMT model and machine learning based on first principles investigation

    Article • Chemical Engineering Journal, June 2022, Elsevier

    Mr Guangzhao Qin

  23. The stable behavior of low thermal conductivity in 1T-sandwich structure with different components

    Article • Journal of Applied Physics, May 2022, American Institute of Physics

    Mr Guangzhao Qin

  24. Measurement of the thermal conductivity of the components of biodiesels: Methyl laurate and methyl myristate

    Article • Fluid Phase Equilibria, May 2022, Elsevier

    Mr Guangzhao Qin

  25. Accessing negative Poisson’s ratio of graphene by machine learning interatomic potentials

    Article • Nanotechnology, April 2022, Institute of Physics Publishing

    Mr Guangzhao Qin

  26. Abnormal enhancement of thermal conductivity by planar structure: A comparative study of graphene-like materials

    Article • International Journal of Thermal Sciences, April 2022, Elsevier

    Mr Guangzhao Qin

  27. Hydrodynamically enhanced thermal transport due to strong interlayer interactions: A case study of strained bilayer graphene

    Article • March 2022, American Physical Society (APS)

    Mr Guangzhao Qin

  28. Half-negative Poisson’s ratio in graphene+ with intrinsic Dirac nodal loop

    Article • Cell Reports Physical Science, March 2022, Elsevier

    Mr Guangzhao Qin

  29. Editorial: A Brief Perspective to the Development of Emerging Thermoelectric Materials

    Article • Frontiers in Materials, February 2022, Frontiers

    Mr Guangzhao Qin

  30. The consistent behavior of negative Poisson's ratio with interlayer interactions

    Article • Materials Advances, January 2022, Royal Society of Chemistry

    Mr Guangzhao Qin

  31. Anisotropy of thermal transport in phosphorene: a comparative first-principles study using different exchange–correlation functionals

    Article • Materials Advances, January 2022, Royal Society of Chemistry

    Mr Guangzhao Qin

  32. Electrically-driven robust tuning of lattice thermal conductivity

    Article • Physical Chemistry Chemical Physics, January 2022, Royal Society of Chemistry

    Mr Guangzhao Qin

  33. High-throughput computational evaluation of lattice thermal conductivity using an optimized Slack model

    Article • Materials Advances, January 2022, Royal Society of Chemistry

    Mr Guangzhao Qin

  34. Anomalous thermal transport behavior in graphene-like carbon nitride (C3N)

    Article • Journal of Materials Chemistry C, January 2022, Royal Society of Chemistry

    Mr Guangzhao Qin

  35. Significantly suppressed thermal transport by doping In and Al atoms in gallium nitride

    Article • Physical Chemistry Chemical Physics, January 2022, Royal Society of Chemistry

    Mr Guangzhao Qin

  36. Anisotropic thermal and electrical transport properties induced high thermoelectric performance in an Ir2Cl2O2 monolayer

    Article • Physical Chemistry Chemical Physics, January 2022, Royal Society of Chemistry

    Mr Guangzhao Qin

  37. Two-dimensional buckling structure induces the ultra-low thermal conductivity: a comparative study of the group GaX (X = N, P, As)

    Article • Journal of Materials Chemistry C, January 2022, Royal Society of Chemistry

    Mr Guangzhao Qin

  38. Two-dimensional layered MSi2N4 (M = Mo, W) as promising thermal management materials: a comparative study

    Article • Physical Chemistry Chemical Physics, January 2022, Royal Society of Chemistry

    Mr Guangzhao Qin

  39. The record low thermal conductivity of monolayer cuprous iodide (CuI) with a direct wide bandgap

    Article • Nanoscale, January 2022, Royal Society of Chemistry

    Mr Guangzhao Qin

  40. Experimental Studies of Thermal Conductivity of Three Biodiesel Compounds: Methyl Pentanoate, Methyl Octanoate, and Methyl Decanoate

    Article • Journal of Chemical & Engineering Data, December 2021, American Chemical Society (ACS)

    Mr Guangzhao Qin

  41. Thermal conductivity measurements for long-chain n-alkanes at evaluated temperature and pressure: n-dodecane and n-tetradecane

    Article • The Journal of Chemical Thermodynamics, November 2021, Elsevier

    Mr Guangzhao Qin

  42. Unique Arrangement of Atoms Leads to Low Thermal Conductivity: A Comparative Study of Monolayer Mg2C

    Article • The Journal of Physical Chemistry Letters, October 2021, American Chemical Society (ACS)

    Mr Guangzhao Qin

  43. On the microscopic view of the low thermal conductivity of buckling two-dimensional materials from molecular dynamics

    Article • Chemical Physics Letters, October 2021, Elsevier

    Mr Guangzhao Qin

  44. Two-dimensional Al2I2Se2: A promising anisotropic thermoelectric material

    Article • Journal of Alloys and Compounds, September 2021, Elsevier

    Mr Guangzhao Qin

  45. Different Effects of Mg and Si Doping on the Thermal Transport of Gallium Nitride

    Article • Frontiers in Materials, August 2021, Frontiers

    Mr Guangzhao Qin

  46. Measurement and modeling of thermal conductivity for short chain methyl esters: Methyl butyrate and methyl caproate

    Article • The Journal of Chemical Thermodynamics, August 2021, Elsevier

    Mr Guangzhao Qin

  47. Uniform Strain-Dependent Thermal Conductivity of Pentagonal and Hexagonal Silicene

    Article • Frontiers in Materials, May 2021, Frontiers

    Mr Guangzhao Qin

  48. Intrinsically low lattice thermal conductivity of monolayer hexagonal aluminum nitride (h-AlN) from first-principles: A comparative study with graphene

    Article • International Journal of Thermal Sciences, April 2021, Elsevier

    Mr Guangzhao Qin

  49. Measurements and calculations of thermal conductivity for liquid n-octane and n-decane

    Article • Fluid Phase Equilibria, April 2021, Elsevier

    Mr Guangzhao Qin

  50. Computationally Guided Synthesis of High Performance Thermoelectric Materials: Defect Engineering in AgGaTe 2

    Article • Advanced Electronic Materials, March 2021, Wiley

    Mr Guangzhao Qin

  51. Novel optimization perspectives for thermoelectric properties based on Rashba spin splitting: a mini review

    Article • Nanoscale, January 2021, Royal Society of Chemistry

    Mr Guangzhao Qin

  52. Activated Lone-Pair Electrons Lead to Low Lattice Thermal Conductivity: A Case Study of Boron Arsenide

    Article • SSRN Electronic Journal, January 2021, Elsevier

    Mr Guangzhao Qin

  53. Correction: Ultra-high thermal conductivities of tetrahedral carbon allotropes with non-simple structures

    Article • Physical Chemistry Chemical Physics, January 2021, Royal Society of Chemistry

    Mr Guangzhao Qin

  54. Ultra-high thermal conductivities of tetrahedral carbon allotropes with non-simple structures

    Article • Physical Chemistry Chemical Physics, January 2021, Royal Society of Chemistry

    Mr Guangzhao Qin

  55. Ultralow lattice thermal conductivity and dramatically enhanced thermoelectric properties of monolayer InSe induced by an external electric field

    Article • Physical Chemistry Chemical Physics, January 2021, Royal Society of Chemistry

    Mr Guangzhao Qin

  56. The exceptionally high thermal conductivity after ‘alloying’ two-dimensional Gallium Nitride (GaN) and Aluminum Nitride (AlN)

    Article • Nanotechnology, December 2020, Institute of Physics Publishing

    Mr Guangzhao Qin

  57. Negative Poisson’s ratio in two-dimensional honeycomb structures

    Article • npj Computational Materials, May 2020, Springer Science + Business Media

    Mr Guangzhao Qin

  58. Rashba spin splitting and perpendicular magnetic anisotropy of Gd-adsorbed zigzag graphene nanoribbon modulated by edge states under external electric fields

    Article • January 2020, American Physical Society (APS)

    Mr Guangzhao Qin, Professor Xu Zuo

  59. Thermal transport properties of GaN with biaxial strain and electron-phonon coupling

    Article • Journal of Applied Physics, January 2020, American Institute of Physics

    Mr Guangzhao Qin, Bingyang Cao

  60. Giant effect of spin–lattice coupling on the thermal transport in two-dimensional ferromagnetic CrI3

    Article • Journal of Materials Chemistry C, January 2020, Royal Society of Chemistry

    Mr Guangzhao Qin

  61. Quasi-bonding driven abnormal isotropic thermal transport in intrinsically anisotropic nanostructure: A study case of phosphorus nanotube array

    Article • Nanotechnology, November 2019, Institute of Physics Publishing

    Mr Guangzhao Qin

  62. Efficient thermal conductivity modulation by manipulating interlayer interactions: A comparative study of bilayer graphene and graphite

    Article • Journal of Applied Physics, September 2019, American Institute of Physics

    Mr Guangzhao Qin

  63. First-principles study of electronic, optical and thermal transport properties of group III–VI monolayer MX (M = Ga, In; X = S, Se)

    Article • Journal of Applied Physics, June 2019, American Institute of Physics

    Mr Guangzhao Qin, Jia-Yue Yang

  64. Exploring T-carbon for energy applications

    Article • Nanoscale, January 2019, Royal Society of Chemistry

    Mr Guangzhao Qin

  65. Disparate strain response of the thermal transport properties of bilayer penta-graphene as compared to that of monolayer penta-graphene

    Article • Physical Chemistry Chemical Physics, January 2019, Royal Society of Chemistry

    Mr Guangzhao Qin

  66. Two-dimensional magnetic metal–organic frameworks with the Shastry-Sutherland lattice

    Article • Chemical Science, January 2019, Royal Society of Chemistry

    Mr Guangzhao Qin

  67. On the diversity in the thermal transport properties of graphene: A first-principles-benchmark study testing different exchange-correlation functionals

    Article • Computational Materials Science, August 2018, Elsevier

    Mr Guangzhao Qin

  68. Lone-pair electrons induced anomalous enhancement of thermal transport in strained planar two-dimensional materials

    Article • Nano Energy, August 2018, Elsevier

    Mr Guangzhao Qin

  69. Dependence of phonon transport properties with stacking thickness in layered ZnO

    Article • Journal of Physics D Applied Physics, June 2018, Institute of Physics Publishing

    Mr Guangzhao Qin

  70. Lone-Pair Electrons Do Not Necessarily Lead to Low Lattice Thermal Conductivity: An Exception of Two-Dimensional Penta-CN2

    Article • The Journal of Physical Chemistry Letters, April 2018, American Chemical Society (ACS)

    Mr Guangzhao Qin

  71. Methodology Perspective of Computing Thermal Transport in Low-Dimensional Materials and Nanostructures: The Old and the New

    Article • ACS Omega, March 2018, American Chemical Society (ACS)

    Mr Guangzhao Qin

  72. Bond saturation significantly enhances thermal energy transport in two-dimensional pentagonal materials

    Article • Nano Energy, March 2018, Elsevier

    Mr Guangzhao Qin

  73. Thermal Transport in Phosphorene

    Article • Small, February 2018, Wiley

    Mr Guangzhao Qin

  74. Thermal transport properties of monolayer phosphorene: a mini-review of theoretical studies

    Article • Frontiers in Energy, January 2018, Springer Science + Business Media

    Mr Guangzhao Qin

  75. Accelerating evaluation of converged lattice thermal conductivity

    Article • npj Computational Materials, January 2018, Nature

    Mr Guangzhao Qin

  76. A C20 fullerene-based sheet with ultrahigh thermal conductivity

    Article • Nanoscale, January 2018, Royal Society of Chemistry

    Mr Guangzhao Qin

  77. Origin of anisotropic negative Poisson's ratio in graphene

    Article • Nanoscale, January 2018, Royal Society of Chemistry

    Mr Guangzhao Qin

  78. Unconventional thermal transport enhancement with large atom mass: a comparative study of 2D transition dichalcogenides

    Article • 2D Materials, November 2017, Institute of Physics Publishing

    Mr Guangzhao Qin

  79. Unprecedented mechanical response of the lattice thermal conductivity of auxetic carbon crystals

    Article • Carbon, October 2017, Elsevier

    Mr Guangzhao Qin

  80. Anomalously temperature-dependent thermal conductivity of monolayer GaN with large deviations from the traditional 1/T law

    Article • May 2017, American Physical Society (APS)

    Mr Guangzhao Qin

  81. Metric for strong intrinsic fourth-order phonon anharmonicity

    Article • May 2017, American Physical Society (APS)

    Mr Guangzhao Qin

  82. Thermal transport in novel carbon allotropes with sp2 or

    Article • February 2017, American Physical Society (APS)

    Mr Guangzhao Qin

  83. Low thermal conductivity of monolayer ZnO and its anomalous temperature dependence

    Article • Physical Chemistry Chemical Physics, January 2017, Royal Society of Chemistry

    Mr Guangzhao Qin

  84. Orbitally driven low thermal conductivity of monolayer gallium nitride (GaN) with planar honeycomb structure: a comparative study

    Article • Nanoscale, January 2017, Royal Society of Chemistry

    Mr Guangzhao Qin

  85. External electric field driving the ultra-low thermal conductivity of silicene

    Article • Nanoscale, January 2017, Royal Society of Chemistry

    Mr Guangzhao Qin

  86. Unconventional magnetic anisotropy in one-dimensional Rashba system realized by adsorbing Gd atom on zigzag graphene nanoribbons

    Article • Nanoscale, January 2017, Royal Society of Chemistry

    Mr Guangzhao Qin, Professor Xu Zuo

  87. Nontrivial contribution of Fröhlich electron-phonon interaction to lattice thermal conductivity of wurtzite GaN

    Article • Applied Physics Letters, December 2016, American Institute of Physics

    Mr Guangzhao Qin

  88. Resonant bonding driven giant phonon anharmonicity and low thermal conductivity of phosphorene

    Article • October 2016, American Physical Society (APS)

    Mr Guangzhao Qin

  89. Insight into the collective vibrational modes driving ultralow thermal conductivity of perovskite solar cells

    Article • September 2016, American Physical Society (APS)

    Mr Guangzhao Qin

  90. Diverse Thermal Transport Properties of Two-Dimensional Materials: A Comparative Review

    Article • August 2016, IntechOpen

    Mr Guangzhao Qin

  91. Surface Chemical Tuning of Phonon and Electron Transport in Free-Standing Silicon Nanowire Arrays

    Article • Nano Letters, August 2016, American Chemical Society (ACS)

    Mr Guangzhao Qin

  92. Methodology for determining the electronic thermal conductivity of metals via direct nonequilibriumab initiomolecular dynamics

    Article • August 2016, American Physical Society (APS)

    Mr Guangzhao Qin

  93. Disparate Strain Dependent Thermal Conductivity of Two-dimensional Penta-Structures

    Article • Nano Letters, June 2016, American Chemical Society (ACS)

    Mr Guangzhao Qin

  94. Strain-modulated electronic and thermal transport properties of two-dimensional O-silica

    Article • Nanotechnology, May 2016, Institute of Physics Publishing

    Mr Guangzhao Qin

  95. Corrigendum: Hinge-like structure induced unusual properties of black phosphorus and new strategies to improve the thermoelectric performance

    Article • Scientific Reports, March 2016, Nature

    Mr Guangzhao Qin

  96. Large tunability of lattice thermal conductivity of monolayer silicene via mechanical strain

    Article • February 2016, American Physical Society (APS)

    Mr Guangzhao Qin

  97. Tinselenidene: a Two-dimensional Auxetic Material with Ultralow Lattice Thermal Conductivity and Ultrahigh Hole Mobility

    Article • Scientific Reports, February 2016, Nature

    Mr Guangzhao Qin

  98. Diverse anisotropy of heat transfer in hinge-like structures

    Article • Nanoscale, January 2016, Royal Society of Chemistry

    Mr Guangzhao Qin

  99. Phonon transport in the ground state of two-dimensional silicon and germanium

    Article • RSC Advances, January 2016, Royal Society of Chemistry

    Mr Guangzhao Qin

  100. Phonon transport properties of phosphorene

    Article • Physical Chemistry Chemical Physics, January 2015, Royal Society of Chemistry

    Mr Guangzhao Qin

  101. Energetics and magnetism of Co-doped GaN(0001) surfaces: A first-principles study

    Article • Journal of Applied Physics, December 2014, American Institute of Physics

    Mr Guangzhao Qin

  102. Strain modulated geometric, electronic and thermoelectric properties of Black Phosphorus

    Article • Scientific Reports, November 2014, Nature

    Mr Guangzhao Qin

  103. Thermal conductivity of silicene calculated using an optimized Stillinger-Weber potential

    Article • Physical Review B, February 2014, American Physical Society (APS)

    Mr Guangzhao Qin

  104. Behavior of aluminum adsorption and incorporation at GaN(0001) surface: First-principles study

    Article • Journal of Applied Physics, November 2013, American Institute of Physics

    Mr Guangzhao Qin