As. Ansari et Sn. Pandis, An analysis of four models predicting the partitioning of semivolatile inorganic aerosol components, AEROS SCI T, 31(2-3), 1999, pp. 129-153
A comparison is conducted between 3 atmospheric equilibrium models: GFEMN,
ISORROPIA, SCAPE2, and SEQUILIB. While ISORROPIA, SCAPE2, and SEQUILIB simp
lify the problem at hand in an effort to reduce computational rigor, GFEMN
does not employ many of the simplifying assumptions used in previous models
, thus allowing it to accurately predict multistage aerosol behavior and de
liquescence depression. We examine model performance for representative atm
ospheric environments over an extended composition, temperature, and RH dom
ain and against observations in Southern California. The predictions of GFE
MN, ISORROPIA, SCAPE2, and SEQUILIB are in general agreement, but the latte
r 3 do not adequately reproduce multistage deliquescence behavior for multi
component systems. The most notable differences in model predictions occur
for H+ and aerosol water concentrations; discrepancies in predictions of ae
rosol nitrate and total dry inorganic Phl concentrations are not as signifi
cant. The models predict different deliquescence relative humidities for mu
lticomponent systems, but for ammonia poor environments, these discrepancie
s do not introduce differences in total dry inorganic PM predictions. Again
st measurements taken during the Southern California Air Quality Study (SCA
QS), all models qualitatively reproduce but generally underpredict aerosol
nitrate concentrations. Finally, based on its overall agreement with GFEMN
and its computational efficiency, ISORROPIA appears to be the model of choi
ce for use in large-scale aerosol transport models. In places where crustal
material comprises a significant portion of total PM, SCAPE2 is an alterna
tive.