Harman Patil (Editor)

Axilrod–Teller potential

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The Axilrod–Teller potential is a three-body potential that results from a third-order perturbation correction to the attractive London dispersion interactions (instantaneous induced dipole-induced dipole)

V i j k = E 0 [ 1 + 3 cos γ i cos γ j cos γ k ( r i j r j k r i k ) 3 ]

where r i j is the distance between atoms i and j , and γ i is the angle between the vectors r i j and r i k . The coefficient E 0 is positive and of the order V α 3 , where V is the ionization energy and α is the mean atomic polarizability; the exact value of E 0 depends on the magnitudes of the dipole matrix elements and on the energies of the p orbitals.

References

Axilrod–Teller potential Wikipedia