The Kohn-Sham gap, the fundamental gap and the optical gap: the physical meaning of occupied and virtual Kohn-Sham orbital energies von Baerends, E. J, Gritsenko, O. V, van Meer, R

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Physical Meaning of Virtual Kohn–Sham Orbitals and Orbital Energies: An Ideal Basis for the Description of Molecular Excitations von van Meer, R, Gritsenko, O. V, Baerends, E. J

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A Quantum Chemical View of Density Functional Theory von Baerends, E. J, Gritsenko, O. V

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Time-dependent Dyson orbital theory von Gritsenko, O. V, Baerends, E. J

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Interpretation of the Kohn–Sham orbital energies as approximate vertical ionization potentials von Chong, D. P., Gritsenko, O. V., Baerends, E. J.

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On the errors of local density (LDA) and generalized gradient (GGA) approximations to the Kohn-Sham potential and orbital energies von Gritsenko, O. V., Mentel, Ł. M., Baerends, E. J.

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A non-JKL density matrix functional for intergeminal correlation between closed-shell geminals from analysis of natural orbital configuration interaction expansions von van Meer, R., Gritsenko, O. V., Baerends, E. J.

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The spin-unrestricted molecular Kohn-Sham solution and the analogue of Koopmans's theorem for open-shell molecules von Gritsenko, O V, Baerends, E J

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Away from generalized gradient approximation: Orbital-dependent exchange-correlation functionals von Baerends, E. J., Gritsenko, O. V.

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Electric Field Dependence of the Exchange-Correlation Potential in Molecular Chains von van Gisbergen, S. J. A., Schipper, P. R. T., Gritsenko, O. V., Baerends, E. J., Snijders, J. G., Champagne, B., Kirtman, B.

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Natural excitation orbitals from linear response theories: Time-dependent density functional theory, time-dependent Hartree-Fock, and time-dependent natural orbital functional theo... von van Meer, R., Gritsenko, O. V., Baerends, E. J.

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The role of epicardial obesity in the development of left ventricular diastolic dysfunction von Gritsenko, O V, Chumakova, G A, Trubina, E V

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Laboratory markers of osteosarcopenic obesity von Gritsenko, O. V., Gruzdeva, O. V., Chumakova, G. A., Barbarash, O. L.

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Possibilities for managing the left ventricular diastolic dysfunction risk in obese patients von Gritsenko, O. V., Chumakova, G. A., Gruzdeva, O. V., Subbotin, E. A.

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Response calculations based on an independent particle system with the exact one-particle density matrix: Excitation energies von Giesbertz, K. J. H., Gritsenko, O. V., Baerends, E. J.

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Charge transfer, double and bond-breaking excitations with time-dependent density matrix functional theory von Giesbertz, K J H, Baerends, E J, Gritsenko, O V

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Improved Description of Chemical Barriers with Generalized Gradient Approximations (GGAs) and Meta-GGAs von Grüning, M, Gritsenko, O. V, Baerends, E. J

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Predicting the risk of left ventricular diastolic dysfunction in obesity von Chumakova, G. A., Gritsenko, O. V., Gruzdeva, O. V., Zateev, A. V.

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The density matrix functional approach to electron correlation: dynamic and nondynamic correlation along the full dissociation coordinate von Mentel, Ł M, van Meer, R, Gritsenko, O V, Baerends, E J

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Early diagnosis of myocardial fibrosis in patients with epicardial obesity von Gritsenko, O. V., Chumakova, G. A., Trubina, E. V.

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