Physical Meaning of Virtual Kohn–Sham Orbitals and Orbital Energies: An Ideal Basis for the Description of Molecular Excitations

Title
Physical Meaning of Virtual Kohn–Sham Orbitals and Orbital Energies: An Ideal Basis for the Description of Molecular Excitations
Authors
Keywords
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Journal
Journal of Chemical Theory and Computation
Volume 10, Issue 10, Pages 4432-4441
Publisher
American Chemical Society (ACS)
Online
2014-09-30
DOI
10.1021/ct500727c

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