Active Project

Deprotonation of organic molecules in solution: study of the reaction mechanism and rate by modern techniques for simulating rare events in combination with ab-initio molecular dynamics.

Project details

Project title: Deprotonation of organic molecules in solution: study of the reaction mechanism and rate by modern techniques for simulating rare events in combination with ab-initio molecular dynamics.
Project code: ndphy022a
Project class: A

Start date: Thursday 10 February 2011
End date: Monday 10 February 2014

People

Project PI: Dr. Simone Meloni
Number of users: 2-5
Registered users: 8

Resulting publications

No resulting publications at this time

Allocated resources