Computational Chemistry: Reviews Of Current Trends, Vol. 9

Molecular Dynamics Simulations of a Molecular Electronics Device: The NanoCell (J Seminario et al.); Molecular Electronics with Gaussian98/03 (J J Palacios et al.); Molecular Dynamics Simulations of Single Molecule Atomic Force Microscope Experiments (W Nowak & P E Marszaek); Computation of Excited State Potential Energy Surfaces via Linear Response Theories Based on State Specific Multi-Reference Coupled Electron-pair Approximation Like Methods (S Chattopadhyay et al.); Modelling of Anisotropic Exchange Coupling in Rare-Earth-Transition-Metal Pairs: Applications to Yb3+-Mn2+ and Yb3+-Cr3+ Halide Clusters and Implications to the Light Up-Conversion (M Atanasov et al.); Is a Dihydrogen Bond a Unique Phenomenon? (S J Grabowski & J Leszczynski).