2019 Archives - SCIENOMICS

2019

Chameleon: A Generalized, Connectivity Altering Software for Tackling Properties of Realistic Polymer Systems

Feb 1, 2022

Chameleon, a generalized Monte Carlo software for the phase space analysis of complex, realistic polymer systems is presented. Chameleon implements the so-called connectivity altering technique applied on polymer chains through Monte Carlo moves that do not mimic...

Molecular Dynamics Simulation of Pure n -Alkanes and Their Mixtures at Elevated Temperatures Using Atomistic and Coarse-Grained Force Fields

Feb 1, 2022

The properties of higher n-alkanes and their mixtures is a topic of significant interest for the oil and chemical industry. However, the experimental data at high temperatures are scarce. The present study focuses on simulating n-dodecane, n-octacosane, their binary...

Chameleon: A Generalized, Connectivity Altering Software for Tackling Properties of Realistic Polymer Systems

Molecular Dynamics Simulation of Pure n -Alkanes and Their Mixtures at Elevated Temperatures Using Atomistic and Coarse-Grained Force Fields

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