J. Rieger et al., A RATIONAL APPROACH TO THE MECHANISMS OF INCRUSTATION INHIBITION BY POLYMERIC ADDITIVES, Tenside, surfactants, detergents, 34(6), 1997, pp. 430-435
CaCO3 incrustation in washing processes is essentially determined by p
recipitation and crystal growth processes. Knowledge of these processe
s is an important aid in what has so far been a largely empirical proc
edure for the targeted selection or development of additives. To impro
ve understanding of-the processes taking place at the molecular level,
the possibility of carrying out model experiments to investigate crys
tal formation was provided i.e. a method for defined precipitation and
for time-resolved observation of the process of CaCO3 precipitation i
n the presence of-additives was developed. On the basis of the experim
ental work, conclusions may be drawn as to the operating mechanisms of
the additives employed (threshold effect, aggregation behavior, etc).
In molecular modelling various additives are adsorbed onto the main g
rowth surfaces of the calcite and their interaction with these surface
s is calculated. In addition, the dynamic aspects of adsorption are an
alyzed via molecular dynamic simulations. The methods are explained wi
th reference to examples.