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Electrostatic Interactions
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The Born Potential and Short-Range Repulsion
At very short distances ($r < 0.3 \text{ nm}$), quantum mechanical effects, primarily Pauli exclusion principle overlap, dominate over classical Coulombic forces. This short-range repulsion is frequently modeled using an exponential term, often incorporated into the Born-Lande equation for crystal lattices, or a simple $A/r^{12}$ term in molecular mechanics potentials.
Counterion Atmosphere and Screening -
Lattice Energy
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Theoretical Definition and Calculation
The concept of lattice energy is rooted in the Born-Landé equation, which attempts to calculate the energy released upon the hypothetical formation of the crystal from isolated, separated gaseous ions:
$$\Delta H{\text{L}} = -N{\text{A}} \frac{M z^+ z^- e^2}{4 \pi \epsilon0 r0} \left(1 - \frac{1}{n}\right)$$ -
Molecular Bonding
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Ionic Bonding
Ionic bonds form through the complete transfer of one or more valence electrons from a low-ionization-potential atom (typically a metal) to a high-electron-affinity atom (typically a nonmetal). This transfer results in the formation of oppositely charged ions, which are then held together by strong electrostatic attraction (Coulombic forces). The lattice energy ($U$) of an ionic crystal is often modeled using the…