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cond-mat.soft2020★ 9 cited
Coupling between structural relaxation and diffusion in glass-forming liquids under pressure variation
Anh D. Phan, Kajetan Koperwas, Marian Paluch +1
We theoretically investigate structural relaxation and activated diffusion of glass-forming liquids at different pressures using both the Elastically Collective Nonlinear Langevin…
cond-mat.soft2019★ 32 cited
Effects of Cooling Rate on Structural Relaxation in Amorphous Drugs: Elastically Collective Nonlinear Langevin Equation Theory and Machine Learning Study
Anh D. Phan, Katsunori Wakabayashi, Marian Paluch +1
Theoretical approaches are formulated to investigate the molecular mobility under various cooling rates of amorphous drugs. We describe the structural relaxation of a tagged molecu…