LAMMPS input files and analysis for estimating the glass transition temperature using ensemble molecular dynamcs of a selection of epoxy resins using different protocols for computing the density-temperature behaviour.

LAMMPS input files and analysis for estimating the glass transition temperature using ensemble molecular dynamcs of a selection of epoxy resins using different protocols for computing the density-temperature behaviour.本数据集包含LAMMPS输入文件与配套分析文件，旨在通过选取的环氧树脂的系综分子动力学（ensemble molecular dynamics）模拟，结合多种计算密度-温度特性的方案，估算其玻璃化转变温度。