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Beilstein J. Nanotechnol. 2015, 6, 2140–2147, doi:10.3762/bjnano.6.219
Figure 1: Long one-dimensional (1D) atomic chain. Region C (red) is composed of 200 mobile atoms sandwiched b...
Figure 2: The equilibrium frequencies of each vibrational mode (vertical axis). For each eigenfrequency, the ...
Figure 3: Upper panel: for each bias (vertical axis) the elements of the antisymmetric part of the dynamical ...
Figure 4: Main panel: Fourier components (moduli) of the eigenmode with the largest (negative) imaginary part...
Figure 5: Longitudinal atomic displacements in a wire with 200 dynamical atoms as a function of position (hor...
Figure 6: Fourier-decomposed total ionic kinetic energy (colour) across the phonon band, determined using Equation 10, d...
Beilstein J. Nanotechnol. 2011, 2, 727–733, doi:10.3762/bjnano.2.79
Figure 1: An electrode–junction–electrode system in the Landauer picture. The details are discussed in the te...