Module to simulate the specific heat signature of glasses with a specified thermal treatment following the Tool-Narayanaswamy-Moynihan (TNM) model
Predicting polymer-solvent behaviour on a six-state ordinal ladder from undissolved to dissolved, with a continuous solvation coordinate s in [0,1]. Frank-Hall cumulative head, frozen model artifacts, and worked examples of state-based separation design for plastics recycling.
Simulation codes for the high-dimensional model disordered systems
ML framework for predicting particle rearrangements in supercooled liquids and glasses using structure-based descriptors and SVM. Served as a FastAPI microservice with Docker deployment.
聚合物玻璃化转变实时演示 — Kremer–Grest 珠簧模型分子动力学，浏览器内运行 / Real-time Kremer–Grest MD of the glass transition, in your browser
Classifies the dynamical state of a simulated 3D non-confluent tissue (liquid, glass, viscosity-saturated, crystal) from a single trajectory, using a random forest and 1-D CNN over 65 dynamical and structural descriptors.
Glass ballista game thing
Predicting glass transition of a polymer using Graph Neural Netwroks.
A deterministic butterfly cone in a structural glass, with its ceiling set by the Debye-Waller cage amplitude
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