Dynamics and Hydrodynamics of Molecular Superrotors

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Abstract

In recent years, several femtosecond laser techniques have been developed that can make gas molecules rotate extremely fast, whereas the gas stays translationally cold. Herein we use molecular-dynamics simulations to investigate the collisional dynamics of gases of such molecules (“superrotors”). We found that the common route of superrotors to equilibrium is rather generic. It starts with a long-lasting “gyroscopic stage”, during which the molecules keep their fast rotation and the orientation of their angular momentum despite the many collisions they undergo. The inhibited rotational relaxation is characterized by a persistent anisotropy in the molecular angular distribution, manifested in long-lasting optical birefringence and in anisotropic diffusion of the gas. Later, the gyroscopic stage is abruptly terminated by a self-accelerating explosive rotational–translational energy exchange that generates sound and macroscopic vortices with a hot rotating core.

Original languageEnglish
Pages (from-to)3795-3810
Number of pages16
JournalChemPhysChem
Volume17
Issue number22
DOIs
Publication statusPublished - 18 Nov 2016
Externally publishedYes

Keywords

  • computational chemistry
  • laser chemistry
  • molecular dynamics
  • superrotors

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