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22.2.1 Occupied orbitals
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22 THE CI PROGRAM
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22.1 Introduction
22.2 Specifying the wavefunction
Subsections
22.2.1 Occupied orbitals
22.2.2 Frozen-core orbitals
22.2.3 Closed-shell orbitals
22.2.4 Defining the orbitals
22.2.5 Defining the state symmetry
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Feb 26, 2003