DENSITY-FUNCTIONAL THEORY; NORM-CONSERVING PSEUDOPOTENTIALS; MOLECULAR-EXCITATION ENERGIES; EFFECTIVE POTENTIAL METHOD; IMPROVED VIRTUAL ORBITALS; LI-IAFRATE APPROXIMATION; HARTREE-FOCK ORBITALS; EIGENVALUE PROBLEMS; HYDROGEN MOLECULE; EXCITED-STATES
JOURNAL OF CHEMICAL PHYSICS, v.145, no.22
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