Words similar to solvation
Example sentences for: solvation
How can you use “solvation” in a sentence? Here are some example sentences to help you improve your vocabulary:
It might be concluded that the water model is robust, while the chloroform model is ill-parameterized, although the AMSOL literature on solvation [ 18 ] gives little basis for this contention.
4) Use of 6-31G*-quality ESP charges as recommended for the continuum solvation models [ 2b 16 ] leads to conformer 2 , a non-polar type conformer distinct from 1, as the uniform global minimum for both gas phase and solution models (Table 3).
While H 2 O solvation correctly identifies polar
Inspection of Table 4reveals that, unlike the force-field results described in Tables 2and 3, all four semiempirical recipes predict polar conformers 5 and 6 to be the low and "global" minimum energy forms, respectively, when the aqueous solvation continuum model is employed.
[ 2 ] Each was used in the "gas phase" with two continuum solvation models (CHCl 3 , H 2 O) [ 2b ] with default MacroModel atomic charges (Table 2).