Application of density functional theory methods to two dimensional harmonically confined dipolar atoms



Application of density-functional theory to atomic resonances
Erkoç, Şakir; Jansen, HJF (1999-03-01)
Density-functional theory in the local-spin-density approximation has been applied to calculate the energy positions of law-lying resonance (autoionization) states of neutral atoms and positive ions. This method is very convenient fur a quick, approximate prediction of excitation energies in collision experiments. [S1050-2947(99)05401-3]
Application of Relaxation Techniques to Nonconvex Isotropic Damage Model
Birkle, Manuel; Gürses, Ercan; Miehe, Christian (2003-03-28)
A new energy relaxation technique for nonconvex inelasticity is applied to an isotropic damage model. The increasingdamage yields nonconvex incremental potentials indicating the instability of the material and the development of fine-scale microstructures. The microstructures ar e resolved as first-or der laminates by convexifiaction techniques.
Application of light cone qcd sum rules to hadron physics
Özpineci, Altuğ; Savcı, Mustafa; Aliyev, Tahmasib; Department of Physics (2001)
Application of density functional theory to propylene to propylene oxide catalytic reaction
Onay, Deniz; Önal, Işık; Fellah, Mehmet Ferdi; Department of Chemical Engineering (2015)
Current propylene oxide production highly relies on costly and environmentally disadvantageous processes. Direct propylene epoxidation on heterogeneous surface is desired to replace these processes. With this ultimate goal in mind, propylene epoxidation has been investigated on Cu2O(001) and RuO2(110) surfaces. Different elementary steps of the reaction mechanism that result in propylene oxide formation are analyzed on these catalytic models by using Density Functional Theory (DFT) calculations via Vienna A...
Application of the finite difference beam propagation method to optical structures
Uğur, Alper; Sayan, Gönül Turhan; Department of Electrical and Electronics Engineering (1998)
Citation Formats
H. Toffoli, “Application of density functional theory methods to two dimensional harmonically confined dipolar atoms,” 2016, Accessed: 00, 2021. [Online]. Available: