A heterobimetallic Ru(II)-Rh(I) complex has been identified as a potent catalyst precursor for the Oppenauer-type oxidation of alcohols. With 0.1-0.5 mol% of this complex and K2CO3 as the co-catalyst, it is possible to oxidize secondary and primary alcohol ...
Pd nanoparticles (2 nm) stabilized in the micelle core of poly(ethylene oxide)-block-poly(2-vinylpyridine) were studied in partial hydrogenation of 2-butyne-1,4-diol. Both unsupported micelles (0.6 kg Pd/m3) and supported ones on g-Al2O3 (0.042% Pd) showed ...
The optical properties of mols. in complex environments were studied within hybrid time-dependent d. functional theory / mol. mechanics (TDDFT/MM) simulation studies. The potential energy surface in the excited state is described within time-dependent d. f ...