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A brief description of each atom mapping algorithm follows.
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Going beyond this qualitative argument, the quantitative properties of atoms are calculated by solving the Schrödinger wave equation, which provides the quantum mechanical description of an atom.
In his summation, the chief prosecutor, Irving Saypol, declared: "This description of the atom bomb, destined for delivery to the Soviet Union, was typed up by the defendant Ethel Rosenberg that afternoon at her apartment at 10 Monroe Street.
He told the jury that in typing up Greenglass' description of the atom bomb Ethel Rosenberg had "struck the keys, blow by blow, against her own country".
The mapping of atoms ensures that each atom is considered equally and the description of the atoms ensures a fine grained weighting through their environment.
The detailed description of atom neighborhoods used in the AAP similarity allows for the differentiation of even small changes in molecular structure.
Wen-Fang [21] presented a description of the helium atom under spherical parabolic confinement potential using the adiabatic hyperspherical method.
The technique uses explicit description of atom locations with no adjustable potential parameters and thus allows parametric study of molecular structural features such as non-planar aliphatic rings, irregularly-shaped polyaromatic cores, and methyl groups.
A more accurate description of the hydrogen atom comes from a purely quantum mechanical treatment that uses the Schrödinger equation, Dirac equation or even the Feynman path integral formulation to calculate the probability density of the electron around the proton.
For HAT, the reactant and product Hamiltonians need to be constructed considering the electronic coordinate or an overall description of the hydrogen atom.
Here the valence of each atom is taken into account.
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CEO of Professional Science Editing for Scientists @ prosciediting.com