Browsing School of Chemistry (Scholarly Articles) by Subject "density functional calculations"
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Crystallization of organic salts from the gas phase: When does proton transfer take place?
(American Chemical Society, 2020-12-13)Salt formation with proton transfer is observed in crystals grown by cosublimation of the salt coformers. Diflunisal salts were obtained with 4-[3-(pyridin-4-yl)propyl]pyridine, piperazine, and 4-dimethylaminopyridine. ...