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000092781 1001_ $$aLandt, L.
000092781 1101_ $$aDESY$$bExperiments with synchrotron radiation
000092781 245__ $$aThe influence of a single thiol group on the electronic and optical properties of the smallest diamond adamantane
000092781 260__ $$aMelville, NY$$bAmerican Institute of Physics$$c2010
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000092781 440_0 $$0PERI:(DE-600)1473050-9$$aJ. Chem. Phys.$$v132$$x0021-9606
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000092781 520__ $$aAt the nanoscale, the surface becomes pivotal for the properties of semiconductors due to an increased surface-to-bulk ratio. Surface functionalization is a means to include semiconductor nanocrystals into devices. In this comprehensive experimental study we determine in detail the effect of a single thiol functional group on the electronic and optical properties of the hydrogen-passivated nanodiamond adamantane. We find that the optical properties of the diamondoid are strongly affected due to a drastic change in the occupied states. Compared to adamantane, the optical gap in adamantane-1-thiol is lowered by approximately 0.6 eV and UV luminescence is quenched. The lowest unoccupied states remain delocalized at the cluster surface leaving the diamondoid's negative electron affinity intact.
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000092781 7001_ $$aStaiger, M.
000092781 7001_ $$aWolter, D.
000092781 7001_ $$aKlünder, K.
000092781 7001_ $$aZimmermann, P.
000092781 7001_ $$aWilley, T. M.
000092781 7001_ $$avan Buuren, T.
000092781 7001_ $$aBrehmer, D.
000092781 7001_ $$aSchreiner, P. R.
000092781 7001_ $$aTkachenko, B. A.
000092781 7001_ $$aFokin, A. A.
000092781 7001_ $$aMöller, T.
000092781 7001_ $$aBostedt, C.
000092781 773__ $$0PERI:(DE-600)1473050-9$$a10.1063/1.3280388$$gVol. 132, p. 024710$$p024710$$q132<024710$$tThe @journal of chemical physics$$v132$$x0021-9606$$y2010
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