β Scribed by Gadre, Shridhar R.; Shrivastava, Indira H.
No coin nor oath required. For personal study only.
π SIMILAR VOLUMES
## The Electrostatic Molecular Potential approach is used to estimate the influence of the oxygen and chlorine valence electrons on the Lewis acidity of the aluminium atoms in Hz AlOH and H,AlCl respectively. The potentials are computed using the electron density distribution arising from CNDO/2 w
We investigated the dependence of the electrostatic potential on the size and the shape of various cluster models of the MgO(100) surface. Both Mg2+ and 0'-adsorption sites have been considered. The clusters were embedded in a large array of point charges to provide a representation of the Madelung
MEPSIM is a computational system which allows an integrated computation, analysis, and comparison of molecular electrostatic potential (MEP) distributions. It includes several modules. Module MEPPLA supplies MEP values for the points of a grid defined on a plane which is specified by a set of three