Formation and Evolution of Single Molecule Junctions

We analyze the formation and evolution statistics of single molecule junctions bonded to gold electrodes using amine, methyl sulfide and dimethyl phosphine link groups by measuring conductance as a function of junction elongation. For each link, maximum elongation and formation probability increase with molecular length, strongly suggesting that processes other than just metal-molecule bond breakage play a key role in junction evolution under stress. Density functional theory calculations of adiabatic trajectories show sequences of atomic-scale changes in junction structure, including shifts in attachment point, that account for the long conductance plateau lengths observed.Comment: 10 pages, 4 figures, submitte

Micromanagement: An Employee’s Adversary

Leadership is the ability of an individual to initiate guidance and influence a group or an organization in order to maximize its performance. Micromanagement leadership is one such form, where the managers closely monitor and direct their subordinates. Although a select few managers and employees could benefit from such a practice, micromanagement, as a leadership style has relatively more negative implications on an employee’s behavior and his engagement towards the work at hand. This creates a sense of perceived stress leading him to behave in a counterproductive manner. In this article, we have intended to develop a theoretical framework by investigating from an employee’s perspective. Thus, highlighting the various implications of micromanaging. Interrelating the concepts of employee disengagement, perceived stress and deviant behavior, our study provides several implications for organizations and managers alike apart from a theoretical literature base for further study. Keywords: Micromanagement, Employee Disengagement, Perceived Stress, Leadershi

Quasi-equilibrium optical nonlinearities in spin-polarized GaAs

Semiconductor Bloch equations, which microscopically describe the dynamics of a Coulomb interacting, spin-unpolarized electron-hole plasma, can be solved in two limits: the coherent and the quasi-equilibrium regime. These equations have been recently extended to include the spin degree of freedom, and used to explain spin dynamics in the coherent regime. In the quasi-equilibrium limit, one solves the Bethe-Salpeter equation in a two-band model to describe how optical absorption is affected by Coulomb interactions within a spin-unpolarized plasma of arbitrary density. In this work, we modified the solution of the Bethe-Salpeter equation to include spin-polarization and light holes in a three-band model, which allowed us to account for spin-polarized versions of many-body effects in absorption. The calculated absorption reproduced the spin-dependent, density-dependent and spectral trends observed in bulk GaAs at room temperature, in a recent pump-probe experiment with circularly polarized light. Hence our results may be useful in the microscopic modelling of density-dependent optical nonlinearities in spin-polarized semiconductors.Comment: 7 pages, 6 figure

Understanding highly excited states via parametric variations

Highly excited vibrational states of an isolated molecule encode the vibrational energy flow pathways in the molecule. Recent studies have had spectacular success in understanding the nature of the excited states mainly due to the extensive studies of the classical phase space structures and their bifurcations. Such detailed classical-quantum correspondence studies are presently limited to two or quasi two dimensional systems. One of the main reasons for such a constraint has to do with the problem of visualization of relevant objects like surface of sections and Wigner or Husimi distributions associated with an eigenstate. This neccesiates various alternative techniques which are more algebraic than geometric in nature. In this work we introduce one such method based on parametric variation of the eigenvalues of a Hamiltonian. It is shown that the level velocities are correlated with the phase space nature of the corresponding eigenstates. A semiclassical expression for the level velocities of a single resonance Hamiltonian is derived which provides theoretical support for the correlation. We use the level velocities to dynamically assign the highly excited states of a model spectroscopic Hamiltonian in the mixed phase space regime. The effect of bifurcations on the level velocities is briefly discussed using a recently proposed spectroscopic Hamiltonian for the HCP molecule.Comment: 12 pages, 9 figures, submitted to J. Chem. Phy