Logo del repository
  1. Home
 
Opzioni

Stochastic thermostats: comparison of local and global schemes

Bussi, G.
•
Parrinello, M.
2008
  • journal article

Periodico
COMPUTER PHYSICS COMMUNICATIONS
Abstract
We show that a recently introduced stochastic thermostat [J. Chem. Phys. 126 (2007) 014101] can be considered as a global version of the Langevin thermostat. We compare the global scheme and the local one (Langevin) from a formal point of view and through practical calculations on a model Lennard-Jones liquid. At variance with the local scheme, the global thermostat preserves the dynamical properties for a wide range of coupling parameters, and allows for a faster sampling of the phase-space.
DOI
10.1016/j.cpc.2008.01.006
WOS
WOS:000257539600007
Archivio
http://hdl.handle.net/20.500.11767/13948
info:eu-repo/semantics/altIdentifier/scopus/2-s2.0-44649109173
https://arxiv.org/abs/0803.4397
Diritti
closed access
Soggetti
  • Molecular dynamics

  • Thermostats

  • Time steps

  • Settore FIS/03 - Fisi...

Scopus© citazioni
89
Data di acquisizione
Jun 7, 2022
Vedi dettagli
Web of Science© citazioni
108
Data di acquisizione
Mar 28, 2024
Visualizzazioni
5
Data di acquisizione
Apr 19, 2024
Vedi dettagli
google-scholar
Get Involved!
  • Source Code
  • Documentation
  • Slack Channel
Make it your own

DSpace-CRIS can be extensively configured to meet your needs. Decide which information need to be collected and available with fine-grained security. Start updating the theme to match your nstitution's web identity.

Need professional help?

The original creators of DSpace-CRIS at 4Science can take your project to the next level, get in touch!

Realizzato con Software DSpace-CRIS - Estensione mantenuta e ottimizzata da 4Science

  • Impostazioni dei cookie
  • Informativa sulla privacy
  • Accordo con l'utente finale
  • Invia il tuo Feedback