A comprehensive tutorial derives and organizes the standard machinery of periodic wavefunction quantum chemistry from Ewald Hamiltonians through HF, MP2, CC, finite-size corrections, and local/embedding methods.
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Wavefunction-based periodic quantum chemistry
A comprehensive tutorial derives and organizes the standard machinery of periodic wavefunction quantum chemistry from Ewald Hamiltonians through HF, MP2, CC, finite-size corrections, and local/embedding methods.