Molecular dynamics simulation of organic materials: structure, potentials and the MiCMoS computer platform
A. Gavezzotti, Leonardo Lo Presti, Silvia Rizzato
Abstract
Molecular dynamics simulation shows atoms in action: liquids, crystals, mesophases, nanoparticles trace their paths in time, temperature and pressure in a computing platform designed for organic small molecules.
Topics & Concepts
Molecular dynamicsTRACE (psycholinguistics)Chemical physicsMoleculeMaterials scienceAction (physics)Dynamics (music)NanoparticleOrganic moleculesNanotechnologyChemistryComputational chemistryOrganic chemistryPhysicsLinguisticsPhilosophyAcousticsQuantum mechanicsAdvanced Physical and Chemical Molecular InteractionsAdvanced Chemical Physics StudiesVarious Chemistry Research Topics