Water Molecule's Electron Density
The electron density surface defines the overall shape of the molecule. The surface shown here connects all the points around the molecule where the electron density = 0.03 e-/unit volume. About 90% of the molecule's electrons are located within this volume. Here, the spacefill display corresponds to a 0.03 electron density surface. The density X-section reports the electron density in the plane of the atoms. The blue-to-red color spectrum corresponds to a density range from 0.0 to 0.3 e-/unit volume. |
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Theory: B3LYP; basis: 6-31G(d,p); solvation: SMD.