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2022年9月2日—TheHamiltonianOperator.TheHamiltonianoperatorisnamedaftertheIrishmathematicianWilliamHamiltonandcomesfromthehisformulation ...,MolecularHamiltonian,theHamiltonianoperatorrepresentingtheenergyoftheelectronsandnucleiinamolecule.Hamilto...
Lecture 2 Hamiltonian operators for molecules CHEM6085
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TheHamiltonianoperator(=totalenergyoperator)isasumoftwooperators:thekineticenergyoperatorandthepotentialenergyoperator.Kineticenergy ...
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