Authors: Schreckenbach, G Wolff, SK Ziegler, T

Citation: G. Schreckenbach et al., NMR shielding calculations across the periodic table: Diamagnetic uranium compounds. 1. Methods and issues, J PHYS CH A, 104(35), 2000, pp. 8244-8255

Authors: Hay, PJ Martin, RL Schreckenbach, G

Citation: Pj. Hay et al., Theoretical studies of the properties and solution chemistry of AnO(2)(2+)and AnO(2)(+) aquo complexes for An = U, Np, and Pu, J PHYS CH A, 104(26), 2000, pp. 6259-6270

Authors: Bouten, R Baerends, EJ van Lenthe, E Visscher, L Schreckenbach, G Ziegler, T

Citation: R. Bouten et al., Relativistic effects for NMR shielding constants in transition metal oxides using the zeroth-order regular approximation, J PHYS CH A, 104(23), 2000, pp. 5600-5611

Authors: Schreckenbach, G

Citation: G. Schreckenbach, Mixed uranium chloride fluorides UF6-nCln and methoxyuranium fluorides UF6-n(OCH3)(n): A theoretical study of equilibrium geometries, vibrational frequencies, and the role of the f orbitals, INORG CHEM, 39(6), 2000, pp. 1265-1274

Authors: Schreckenbach, G Hay, PJ Martin, RL

Citation: G. Schreckenbach et al., Density functional calculations on actinide compounds: Survey of recent progress and application to [UO2X4](2-) (X = F, Cl, OH) and AnF(6) (An = U, Np, Pu), J COMPUT CH, 20(1), 1999, pp. 70-90

Authors: Schreckenbach, G

Citation: G. Schreckenbach, The Fe-57 nuclear magnetic resonance shielding in ferrocene revisited. A density-functional study of orbital energies, shielding mechanisms, and the influence of the exchange-correlation functional, J CHEM PHYS, 110(24), 1999, pp. 11936-11949