Efficient workflow for the investigation of the catalytic cycle of water oxidation catalysts Combining GFN-xTB and density functional theory

von Menzel, Jan Paul
Veröffentlicht in: Journal of computational chemistry (2021)

Characterisation of uniformly 13C, 15N labelled bacteriochlorophyll a and bacteriopheophytin a in solution and in solid state complete assignment of the 13C, 1H and 15N chemical sh...

von Egorova-Zachernyuk, Tatiana
Veröffentlicht in: Magnetic resonance in chemistry : MRC (2008)