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Journal of the American Chemical Society|July 18, 2001
A theoretical investigation of the remarkable nuclear spin-spin coupling pattern in [(NC)(5)Pt-Tl(CN)](-)J Autschbach, T ZieglerJournal of the American Chemical Society|July 18, 2001
Solvent effects on heavy atom nuclear spin-spin coupling constants: a theoretical study of Hg-C and Pt-P couplingsJ Autschbach, T ZieglerChemistryopen|March 5, 2024
Triplet-Singlet Emission of d-Block Metal Complexes Characterized by Spin-Orbit Natural Transition OrbitalsA Zaichenko, J AutschbachThe Journal of Chemical Physics|June 25, 2005
Finite lifetime effects on the polarizability within time-dependent density-functional theoryL Jensen, J Autschbach, G C SchatzThe Journal of Chemical Physics|October 9, 2007
Resonance vibrational Raman optical activity: a time-dependent density functional theory approachL Jensen, J Autschbach, M Krykunov, et al.The Journal of Chemical Physics|December 27, 2005
Theory and method for calculating resonance Raman scattering from resonance polarizability derivativesL Jensen, L L Zhao, J Autschbach, et al.Journal of Computational Chemistry|May 16, 2002
Dependence of relativistic effects on electronic configuration in the neutral atoms of d- and f-block elementsJ Autschbach, S Siekierski, M Seth, et al.The Journal of Chemical Physics|November 30, 2006
Magic alkali-fullerene compound clusters of extreme thermal stabilityA Enders, N Malinowski, D Ievlev, et al.Dalton Transactions (Cambridge, England : 2003)|June 29, 2016
The roles of 4f- and 5f-orbitals in bonding: a magnetochemical, crystal field, density functional theory, and multi-reference wavefunction studyW W Lukens, M Speldrich, P Yang, et al.Dalton Transactions (Cambridge, England : 2003)|January 3, 2025
Correction: The roles of 4f- and 5f-orbitals in bonding: a magnetochemical, crystal field, density functional theory, and multi-reference wavefunction studyW W Lukens, M Speldrich, P Yang, et al.Pageof 2