<p>We employ extensive <Emphasis Type="BoldItalic">NPT</Emphasis> molecular dynamics simulations to explore the thermal transitions of two-dimensional colloidal crystals interacting via a core-softened potential with competing length scales. The system stabilizes three distinct solid phases, namely low-density triangular (LDT), stripe, and kagome, which exhibit markedly different responses to heating and cooling. Our simulations reveal that the LDT and kagome phases melt via first-order transitions, but only the former recrystallizes smoothly. The kagome phase displays strong hysteresis and metastability, while the stripe phase undergoes a continuous and nearly reversible transformation. These results highlight the role of lattice geometry and frustration in shaping non-universal melting and freezing pathways in 2D soft matter.</p>

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Order-Disorder Transitions and Thermal Pathways in Frustrated 2D Colloidal Crystals

  • Alexandre Vargas Ilha,
  • Thiago Puccinelli,
  • José Rafael Bordin

摘要

We employ extensive NPT molecular dynamics simulations to explore the thermal transitions of two-dimensional colloidal crystals interacting via a core-softened potential with competing length scales. The system stabilizes three distinct solid phases, namely low-density triangular (LDT), stripe, and kagome, which exhibit markedly different responses to heating and cooling. Our simulations reveal that the LDT and kagome phases melt via first-order transitions, but only the former recrystallizes smoothly. The kagome phase displays strong hysteresis and metastability, while the stripe phase undergoes a continuous and nearly reversible transformation. These results highlight the role of lattice geometry and frustration in shaping non-universal melting and freezing pathways in 2D soft matter.