Ab initio QM/MM dynamics of H3O+ in water.

Pathumwadee Intharathep Anan Tongraar Kritsana Sagarik

Published in: J. Comput. Chem. (2006)

Keyphrases

dynamical systems
dynamic model
temporal evolution
water consumption
database
real time
data sets
nonlinear dynamics
highly nonlinear
water supply
rms error
water flow