We report the development of all-diamond microelectrochemical devices, namely, a microelectrode array (MEA), in which a periodic array structure with well-defined diameters, distance, and hexagonal unit cell pattern is micromachined using a combination of state-of-the-art microwave-induced plasma growth and laser ablation shaping techniques to prepare and coat a patterned boron-doped diamond (BDD) substrate with an intrinsic diamond insulating layer. The active BDD element can be tuned to between 10 and 50 microm in diameter with a 10 times diameter center-to-center distance between two adjacent conducting elements, which are exactly coplanar to the dielectric surroundings. This type of device should enable applications in harsh conditions such as high temperature, high pressure, and resistive media under dynamic flow regimes.
A potential energy surface has been constructed for the CO dimer
using the methods of intermolecular
perturbation theory. The electrostatic and induction terms are
described using distributed multipoles and
distributed polarizabilities, the dispersion using anisotropic
dispersion coefficients calculated by Rijks &
Wormer, and the repulsion−penetration by an anisotropic exponential
site-site function fitted to points calculated
by ab initio intermolecular perturbation theory. The
dispersion and induction are damped using Tang-Toennies
damping functions. The potential has been used in diffusion Monte
Carlo calculations of the ground
rovibrational state, and the vibrationally averaged rotational
constants agree well with experiment. The virial
coefficient is also in good agreement with experiment. In order to
achieve this agreement it is necessary to
include C
9 and C
10
dispersion terms. The potential energy surface has two
symmetry-equivalent versions of
each of two low-lying minima, both of which are planar and
approximately T-shaped. A third minimum,
with a planar, slipped anti-parallel structure, has also been located.
There are two nonplanar paths between
the lowest pair of minima, with a barrier of only about 30
cm-1, and one planar path with a slightly
higher
barrier. In the lowest rovibrational state there is a high
probability that the system is in the neighborhood of
the barriers. Consequently, the vibrationally averaged rotational
constants are significantly different from
the values calculated for the equilibrium geometry.
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