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User Community: Computational Chemistry



International collaboration. User Community: Computational Chemistry. Partners: Uni of Perugia. 

Contacts: Antonio Lagana lagana05@gmail.com

 

Electronic structure calculations, Nuclei dynamics and statistical treatments, Molecular dynamics simulations, Assemblage of multiscale simulations, Material-based molecular modelling, Quantum Chemistry/Molecular Dynamics standard data formats

  • Community-wise: Quality based collaborative credit economy, Research based distributed learning
  • ICT-wise: Application porting to GRID/HPC infrastructures, Cross platform scientific workflows, Web-enabled GRID applications

Сделано в MCG
© 2011, Институт теоретической физики им. Н.Н.Боголюбова