what is zero overlap
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Zero differential overlap is an approximation in computational molecular orbital theory that is the central technique of semi-empirical methods in quantum chemistry. When computers were first used to calculate bonding in molecules, it was possible to only calculate diatomic molecules.
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A negative phase overlap results when two orbitals with different phase overlap with each other.A zero overlap will results when orbitals do not overlap at all or do not overlap effectively.A zero overlap of orbitals does not result in bond formation.
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