Publications

Peer-Reviewed Articles

  1. Pandya, H.; Perego, A. and Khabaz F “Stress-induced dynamics of glassy vitrimers with fast bond exchange rate,” J. Appl. Polym. 141:e55039.
  2. Lai, TY; Khabaz, F and Cavicchi, KA. “Influence of solute association on the phase behavior of 12-hydroxystearic acid/n-alkane solutions,” Soft Matter. 2023;19(13):2339-49.
  3. Aowad M, Banik A, Zhang C, Kaiser I, Khan MH, Alves Almeida AC, Lazarenko D, Khabaz F, and Tan KT. “Flexural behavior and microstructural material properties of sandwich foam core under arctic temperature conditions.” Journal of Sandwich Structures & Materials (2023): 10996362231157016.
  4. Pukale DD.; Lazarenko, D.; Aryal, SR., Khabaz, F.; Shriver, LP. and ND Leipzig, ND”Osmotic Contribution of Synthesized Betaine by Choline Dehydrogenase Using In Vivo andIn Vitro Models of Post-traumatic Syringomyelia,” Cellular and Molecular Bioengineering, 1-14, 2022.
  5. Lazarenko, D. and Khabaz, F.; “A Molecular Dynamics Study on the TribologicalPerformance of Imidazolium−Based Ionic Liquids Mixed with Oil in Comparison to PureLiquids,” Fluids 2022, 7(12), 384.
  6. Perego, A.; Lazarenko, D.; Cloitre, M. and Khabaz, F. “Microscopic dynamics and
    viscoelasticity of vitrimers,” Macromolecules 55, 17, 7605–7613, 2022.
  7. Perego, A. and Khabaz, F. “Creep and Recovery in Vitrimers with Fast Exchange
    Reaction”, Macromolecular Rapid Communications, 2200313, 2022.
  8. Di Dio BF, Khabaz F, Bonnecaze RT, and Cloitre M. “Transient Dynamics of Soft Particle
    Glasses in Startup Shear Flow. Part II: Memory and Aging” J. Rheol. 66(4), 717-730, 2022.
  9. Perego, A.; Mani, S. and Khabaz, F. “Rheology of Styrene-Butadiene Rubber: Resolving
    the Gap between Timescales in Simulations and Experiments,” ACS Appl. Polym. Mater.,
    2022, 4, 4, 2314–2322.
  10. Liu, T.; Khabaz, F.; Cloitre, M. and Bonnecaze, R. T. “High Frequency Viscoelasticity of
    Soft Particle Glasses,” J. Rheol. 66, 293, 2022.
  11. Shen, N.; Liu, S.; Kasbe, P.; Khabaz, F.; Kennedy, J. and Xu, W. “Macromolecular
    Engineering and Additive Manufacturing of Poly(styrene-b-isobutylene-b-styrene) (SIBS),”
    ACS Appl. Polym. Mater., 2021.
  12. Perego, A. and Khabaz, F. “Effect of Kinetics of Bond Exchange Reaction on Dynamics
    and Mechanics of Vitrimers,” J. Pol. Sci.,1–13, 2021.
  13. Mani, S.; Khabaz, F.; Liechti, K.; Bonnecaze, R.T. and Haung, R. “A Numerical Study on
    Elastic Properties of Low–Density Two–Dimensional Networks of Crosslinked Long Fibers,”
    Int. J. Solids Struct., 230–231, 111164, 2021.
  14. Balogun, A.; Lazarenko, D. and Khabaz, F., and Khare, R.; “Extending Timescale of
    Molecular Simulations by Using Time-Temperature Superposition Principle: Rheology of
    Ionic Liquids,” Soft Matter, 17, 7210–7220, 2021.
  15. Lazarenko, D. and Khabaz, F.; “Thermodynamics and Rheology of Imidazolium–based
    Ionic Liquids–Oil Mixtures: A Molecular Simulation Study,” J. Phys. Chem. B., 125, 22,
    5897–5908, 2021.
  16. Khabaz, F.; Di Dio, B. F.; Cloitre, M and Bonnecaze, R.T. “Transient Dynamics of Soft
    Particle Glasses in Startup Shear Flow: Part I Microstructure and Timescales,” J. Rheol. 65,
    241, 2021.
  17. Khabaz, F. and Bonnecaze, R.T. “Thermodynamics of Shear-Induced Phase Transition in
  18. Polydisperse Soft Particle Glasses,” Special issue of Phys. Fluids. 33, 013315, 2021.
  19. Perego, A. and Khabaz, F. “Volumetric and Rheological Properties of Vitrimers: A Hybrid
    Molecular Dynamics and Monte-Carlo Simulation Study,” Macromolecules, 53, 19, 8406–
    84162020.
  20. Perego, A. and Khabaz, F. “Thermodynamics, Dynamics, and Rheology of Fuel
    Surrogates: Application of Time-Temperature Superposition Principle in Molecular Dynamics Simulations,” Energy & Fuels, 34, 9, 1061-10641, 2020.
  21. Das, S.; Khabaz, F.; N.; Nguyen, Q. and Bonnecaze, R. T. “Molecular Dynamics
    Simulations of Aqueous Nonionic Surfactants on a Carbonate Surface,” J. Phys. Chem. B, 124, 37, 8158–8166, 2020.
  22. Bonnecaze, R. T.; Khabaz, F.; Mohan, L.; Cloitre, M. “Excess Entropy Scaling for Soft
    Particle Glasses,” Special issue of J. Rheol., 64, 423, 2020.
  23. Khabaz, F.; Cloitre, M. and Bonnecaze, R. T. “Particle Dynamics Predicts Shear Rheology
    of Soft Particle Glasses,” Special issue of J. Rheol., 64, 459, 2020.
  24. Howard M. P.; Jadrich R. B.; Lindquist, B. A.; Khabaz, F., Bonnecaze, R. T.; Milliron, D.
    J. and Truskett, M. “Structure and Phase Behavior of Polymer-Linked Colloidal Gels,” J.
    Chem. Phys. 151 (12), 124901, 2019.
  25. Jiang, T.; Khabaz, F.; Marne, A; Wu, C.; Gearba, R.; Bodepudi, R., Bonnecaze, R. T.,
    Liechti, K. M. and Korgel, B. A. “Mechanical Properties of Hydrogenated Amorphous Silicon
    (a-Si:H) Particles,” J. Appl. Phys., 126, 2019.
  26. Kadulkar, S.; Banerjee, D.; Khabaz, F.; Ganesan, V.; Truskett, T. and Bonnecaze, R. T.
    “Influence of Morphology of Colloidal Nanoparticle Gels on Ion Transport and Rheology,” J. Chem. Phys. 150 (21), 214903, 2019.
  27. Fallah, F.; Khabaz, F.; Kim Y-R, Kommidi; S. R. and Haghshenas, H. “Molecular
    Dynamics Modeling and Simulation of Asphalt Binder Chemical Aging Due to Variation of
    Oxidation Level and Saturate-Aromatic-Resin-Asphaltene Fraction,” Fuel, 237, 71-80, 2018.
  28. Liu, T.; Khabaz, F.; Cloitre, M. and Bonnecaze, R. T. “The Universality of the Flow Curve
    for Soft-Particle Glasses,” Soft Matter, 14, 7064-7074 (2018).
  29. Khabaz, F. and Khare, R. “Temperature Dependence of Rheological Properties of Asphalt:
    Application of Time-Temperature-Superposition Principle,” J. Rheol., 62, 941, 2018.
  30. Khabaz, F.; Cloitre, M. and Bonnecaze, R. T. “Structural State Diagram of Concentrated
    Suspensions of Jammed Soft Particles in Oscillatory Shear Flow,” Phys. Rev. Fluids, 3,
    033301, 2018.
  31. Khabaz, F.; Zhang, Y.; Xue, L.; Quitevis E. J.; Maginn E. J. and Khare, R. “Temperature
  32. Dependence of Volumetric and Dynamic Properties of Imidazolium-Based Ionic Liquids,” J.
  33. Phys. Chem. B, 122 (8), 2414-2424, 2018.
  34. Khabaz, F.; Liu, T.; Cloitre, M. and Bonnecaze, R. T. “Shear-Induced Crystallization in
    Jammed Soft Particle Glasses,” Phys. Rev. Fluids, 2, 93301, 2017.
  35. Godbole, R.; Khabaz, F.; Khare, R. and Hedden, R. “Extension of Flory-Rehner Theory to
    Multi Component Polymer Network Solvent Systems,” J. Phys. Chem. B, 121 (33), 7963-7977, 2017.
  36. Habib, T.; Sundaravadivelu Devarajan, D.; Khabaz, F.; Parviz, D.; Achee, T.; Khare, R. and
    Green, M. J. “Co-solvents as Liquid Surfactants for Boron Nitride Nanosheet (BNNS)
    Dispersions,” Langmuir, 32 (44), 11591-11599, 2016.
  37. Khabaz, F.; Mani, S. and Khare, R. “Molecular Origins of Dynamic Coupling between Water
    and Hydrated Polyacrylate Gels,” Macromolecules, 49 (19), 7551-7562, 2016.
  38. Mani, S.; Khabaz, F.; Godbole, R. V.; Hedden, R. C. and Khare, R. “Structure and Hydrogen
    Bonding of Water in Polyacrylate Gels: Effects of Polymer Hydrophilicity and Water
    Concentration,” J. Phys. Chem. B, 119 (49), 15381-15393, 2015.
  39. Zhang, Y.; Xue, L.; Khabaz, F.; Doerfler, R; Khare, R; Quitevis, E. L. and Maginn, E. J.
    “Molecular Topology and Local Dynamics Govern the Viscosity of Imidazolium-Based Ionic
    Liquids,” J. Phys. Chem. B, 119 (47), 14934-14944, 2015.
  40. Khabaz, F. and Khare, R. “Glass Transition and Molecular Mobility in Styrene-Butadiene
    Rubber Modified Asphalt,” J. Phys. Chem. B, 119 (44), 14261-14269, 2015.
  41. Bari, R.; Parviz, D; Khabaz, F.; Klaassen, C. D.; Metzler, S. D; Hansen, M. J.; Khare, R.
    and Green, M. J. “Liquid Phase Exfoliation and Crumpling of Inorganic Nanosheets,” Phys.
    Chem. Chem. Phys., 17 (14), 938, 2015.
  42. Khabaz, F. and Khare, R. “Effect of Chain Architecture on the Size, Shape, and Intrinsic
    Viscosity of Chains in Polymer Solutions: A Molecular Simulation Study,” J. Chem. Phys.,
    141 (21), 21409, 2014.
  43. Khare, K. S.; Khabaz, F. and Khare, R. “Effect of Carbon Nanotube Functionalization on
    Mechanical and Thermal Properties of Cross-linked Epoxy-Carbon Nanotube
    Nanocomposites: Role of Strengthening the Interfacial Interactions,” ACS Appl. Mater.
    Interfaces, 6 (9), 6098-6110, 2014.

Conference Proceeding

1. Khabaz, F.; Khare, K. S. and Khare, R., “Temperature Dependence of Creep Compliance of Highly Cross-linked Epoxy: A Molecular Simulation Study”, TIMES OF POLYMERS (TOP) AND COMPOSITES 2014, Book Series: AIP Conference Proceedings, 1599, 262-265, 2014.

Book Chapter

1. Khabaz, F.; Islam, R. and Khare, R; “Thermal Conductivity of Polymer Nanocomposites: Applications of Molecular Dynamics Simulations”, Thermal Behavior and Applications of Carbon-based Nanomaterials, Elsevier Publications, 2020.