Theoretical Chemistry of Gold - Pyykkö - 2004 - Angewandte Chemie International Edition -
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Quantum cascade lasers are unipolar semiconductor lasers covering a wide range of the
infrared and terahertz spectrum. Lasing action is achieved by using optical intersubband …

We have developed an efficient simulation tool'GOLLUM'for the computation of electrical,
spin and thermal transport characteristics of complex nanostructures. The new multi-scale …

By trap** molecules between two gold electrodes with a temperature difference across
them, the junction Seebeck coefficients of 1, 4-benzenedithiol (BDT), 4, 4 …

We explore the prospects to control by use of time-dependent fields quantum transport
phenomena in nanoscale systems. In particular, we study for driven conductors the electron …

Nanotechnology, science, and engineering spearhead the 21st century revolution that is
leading to fundamental breakthroughs in the way materials, devices, and systems are …

We provide a theoretical estimate of the thermoelectric current and voltage over a
Phenyldithiol molecule. We also show that the thermoelectric voltage is (1) easy to …

Progress in nanoscience is becoming increasingly dependent on simulation and modelling.
This is due to a combination of three factors: the reduced size of nano-objects, the …

Manipulating and controlling the self-organisation of small collections of molecules, as an
alternative to investigating individual molecules, has motivated researchers bent on …

The concept of transmission eigenchannels is described in a tight-binding nonequilibrium
Green's function (NEGF) framework. A simple procedure for calculating the eigenchannels is …