The method of calculating the analytical energy gradients for the ground, excited, ionized and electron-attached states Ž . Ž . calculated by the SAC symmetry adapted cluster rSAC-CI configuration interaction method is formulated and implemented. It is adapted with the configuration selection procedure used in the SACrSAC-CI method. The performance of the method is investigated for the Li and C...

The influence of gate-controlled two-electron exchange on the relaxation of nuclear polarization in small ensembles (N∼10(6)) of nuclear spins is examined in a GaAs double quantum dot system. Waiting in the (2,0) charge configuration, which has large exchange splitting, reduces the nuclear diffusion rate compared to that of the (1,1) configuration. Matching exchange to Zeeman splitting signific...

This Letter presents a method of electron entanglement generation. The system under consideration is a single-level quantum dot with one input and two output leads. The leads are arranged such that the dot is empty, single-electron tunneling is suppressed by energy conservation, and two-electron virtual cotunneling is allowed. Such a configuration effectively filters the singlet-state portion o...

multiwall carbon nanotubes (mwcnts) are grown via chemical vapour deposition method directly on a stainless steel substrate. raman spectroscopy and transmission electron microscopy are the techniques chosen to characterize the structure of the synthesized carbon nanotubes: few structural defects are detected. after their removal from the stainless steel substrate, the as-grown mwcnts are then a...

Using density functional theory and the Bardeen, Tersoff, and Hamann formalism we have calculated spin-polarized electron transport in a system involving a nonbonded magnetic probe tip and a self-assembled monolayer SAM of benzene-1,4-dithiol on a Ni 111 substrate. A significantly higher tunneling current is obtained for a configuration in which the spin of the probe tip is aligned parallel to ...

The focus of this work was on designing a label-free DNA biosensor based on a super-sandwich assay using the electrochemical impedance spectroscopy technique. For this purpose, we designed a signal-up configuration whose linker probes could hybridize with two regions of the target DNA. In this configuration, the presented target DNA would effectively decrease the electron transfer, which would ...

In this paper, we present the results of single-electron tunneling in two-dimensional (2D) hexagonal closed packed arrays of palladium nanoparticles. After inspecting the emergence of Coulomb blockade phenomena, we demonstrate the possibilities of using these arrays as a single-electron tunneling based hydrogen sensor. We assumed arrays of palladium nanoparticles with diameters of 3.5 and 6...