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492 related items for PubMed ID: 19475185

  • 21. Electronic spectrum of UO2(2+) and [UO2Cl4]2- calculated with time-dependent density functional theory.
    Pierloot K, van Besien E, van Lenthe E, Baerends EJ.
    J Chem Phys; 2007 May 21; 126(19):194311. PubMed ID: 17523808
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  • 22. A revised electronic Hessian for approximate time-dependent density functional theory.
    Ziegler T, Seth M, Krykunov M, Autschbach J.
    J Chem Phys; 2008 Nov 14; 129(18):184114. PubMed ID: 19045393
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  • 24. Derivation of the RPA (Random Phase Approximation) Equation of ATDDFT (Adiabatic Time Dependent Density Functional Ground State Response Theory) from an Excited State Variational Approach Based on the Ground State Functional.
    Ziegler T, Krykunov M, Autschbach J.
    J Chem Theory Comput; 2014 Sep 09; 10(9):3980-6. PubMed ID: 26588541
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  • 27. On the relation between time-dependent and variational density functional theory approaches for the determination of excitation energies and transition moments.
    Ziegler T, Seth M, Krykunov M, Autschbach J, Wang F.
    J Chem Phys; 2009 Apr 21; 130(15):154102. PubMed ID: 19388731
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  • 29. Spin-adapted open-shell random phase approximation and time-dependent density functional theory. I. Theory.
    Li Z, Liu W.
    J Chem Phys; 2010 Aug 14; 133(6):064106. PubMed ID: 20707560
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  • 30. Modeling the doubly excited state with time-dependent Hartree-Fock and density functional theories.
    Isborn CM, Li X.
    J Chem Phys; 2008 Nov 28; 129(20):204107. PubMed ID: 19045852
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  • 31. Generator coordinate method in time-dependent density-functional theory: memory made simple.
    Orestes E, Capelle K, da Silva AB, Ullrich CA.
    J Chem Phys; 2007 Sep 28; 127(12):124101. PubMed ID: 17902887
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  • 32. Orbital-dependent correlation energy in density-functional theory based on a second-order perturbation approach: success and failure.
    Mori-Sánchez P, Wu Q, Yang W.
    J Chem Phys; 2005 Aug 08; 123(6):62204. PubMed ID: 16122290
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  • 33. Failure of time-dependent density functional theory for long-range charge-transfer excited states: the zincbacteriochlorin-bacteriochlorin and bacteriochlorophyll-spheroidene complexes.
    Dreuw A, Head-Gordon M.
    J Am Chem Soc; 2004 Mar 31; 126(12):4007-16. PubMed ID: 15038755
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  • 36. Oscillator strengths of electronic excitations with response theory using phase including natural orbital functionals.
    van Meer R, Gritsenko OV, Giesbertz KJ, Baerends EJ.
    J Chem Phys; 2013 Mar 07; 138(9):094114. PubMed ID: 23485284
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  • 38. Excitation energies of pi-conjugated oligomers within time-dependent current-density-functional theory.
    van Faassen M, de Boeij PL.
    J Chem Phys; 2004 Dec 01; 121(21):10707-14. PubMed ID: 15549956
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  • 39. Testing Noncollinear Spin-Flip, Collinear Spin-Flip, and Conventional Time-Dependent Density Functional Theory for Predicting Electronic Excitation Energies of Closed-Shell Atoms.
    Xu X, Yang KR, Truhlar DG.
    J Chem Theory Comput; 2014 May 13; 10(5):2070-84. PubMed ID: 26580534
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