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DISSOCIATION OF B2H6 AND ADSORPTION OF THE FRAGMENTS OF B2H6 ON THE STEPPED Ge(100) SURFACE

TÜRKMENOĞLU, MUSTAFA; KATIRCIOĞLU, ŞENAY - In: Surface Review and Letters (SRL) 19 (2012) 03, pp. 1250033-1

by the possible dissociation and adsorption models. The most probable dissociation model of B2H6 and adsorption models of … ~ 1.3 eV. It has been found that, at the first step of the adsorption, BH3 can dissociate to BH2 and BH fragments on the … stepped Ge(100) surface has started with the adsorption of BH3 on the electron deficient site (buckled down) of the Ge dimer …

Persistent link: https://www.econbiz.de/10011011135

DFT STUDY OF CO AND NO ADSORPTION ON BORON NITRIDE (BN)n = 3 - 5 NANOCLUSTERS

ZAHEDI, EHSAN; PANGH, ABDOLHAKIM; GHORBANPOUR, HAMED - In: Surface Review and Letters (SRL) 22 (2015) 01, pp. 1550005-1

function of molecular orbitals in the nearest bonding regions to the Fermi level have confirmed that adsorption of CO by carbon …

Persistent link: https://www.econbiz.de/10011279092

BINDING ENERGIES FOR OXYGEN ON TRANSITION METAL SURFACES

PETROVA, N. V.; YAKOVKIN, I. N. - In: Surface Review and Letters (SRL) 16 (2009) 02, pp. 291-296

The binding energies and related energies of associative desorption for oxygen on close-packed (W(110), Mo(110), and Ru(0001)) and furrowed (W(112), Mo(112), and ${\rm Ru}(10\bar{1}0)$) surfaces have been calculated by DFT method with generalized gradient approximation for exchange-correlation...

Persistent link: https://www.econbiz.de/10004996445