Titlebook: Computations for the Nano-Scale; P. E. Blöchl,C. Joachim,A. J. Fisher Book 1993 Springer Science+Business Media Dordrecht 1993 AFM.Adsorpt

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BILE

Synchrotron Radiation in Structural Biologyproximation, we introduce a novel non-perturbative Green’s function approach which can be used to calculate the transmission properties of thick insulating molecules even when perturbation theory is inapplicable.

欢乐东方

GEST

Molecular and Supramolecular Self-Assembly Processesain intercepted by two or three different π-donor units. By effecting electrochemical control over the translational isomerism present in these [2]rotaxanes, we hope to demonstrate their potential as molecular switching devices.

束以马具

First Principles Calculations of Organometallic Compoundsbromoruthenium(II). The results of constraint-free geometry optimizations are in close agreement with experiment and are comparable in quality with those of the most advanced quantum-chemical techniques.

粘连

Adsorption and STM imaging of organic molecules from first principlesproximation, we introduce a novel non-perturbative Green’s function approach which can be used to calculate the transmission properties of thick insulating molecules even when perturbation theory is inapplicable.

松驰

Local Probe Investigation of Self-Assembled Monolayerssuggesting that there the electron transfer mechanism is the same as on the flat part of the monolayer. Depressions in STM images are due to a decrease in molecular density of the monolayer that causes a local reduction of the electron conductance.

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Electron transport through organic molecules with applications to molecular devicesristic and optical properties of Z-.-(l-hexadecyl-4-quinolinium)-α-cyano-4-styryldicyanomethanide (Q3CNQ) by quantum-chemical methods. Both rectifying characteristics and twist-induced charge transfer (TICT) are demonstrated. This phenomenon may be useful for producing molecular optical memory eleme

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GRIEF

P. H. Fuoss,K. S. Liang,P. Eisenbergersuggesting that there the electron transfer mechanism is the same as on the flat part of the monolayer. Depressions in STM images are due to a decrease in molecular density of the monolayer that causes a local reduction of the electron conductance.