Yayıncı "Walter De Gruyter Gmbh" Fizik Bölümü Koleksiyonu için listeleme
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Molecular, vibrational and electronic structure of 4-bromo-2-halogenobenzaldehydes: Halogen and solvent effects
(Walter De Gruyter Gmbh, 2017)The halogen and solvent effects on the structure of 4-bromo-2-halogenobenzaldehydes [C7H4BrXO; X = F (BFB), Cl (BCB) or Br (BBB)] were investigated by the density functional theory (DFT) and time-dependent density functional ... -
Theoretical insight of alpha amino acid phenylalanine adsorption on pristine and decorated fullerenes
(Walter De Gruyter Gmbh, 2019)Fullerenes, with their extensive application potentials, have been receiving attention for their possible usage as drug delivery vehicles and devices for sensor technologies. In this work, the optimized molecular geometries, ...