Browsing "Chemical Engineering / Kimya Mühendisliği" by Subject Density functional theory

Showing results 1 to 3 of 3
Issue DateTitleAuthor(s)
2023Atomic-scale insights into carbon dioxide hydrogenation over bimetallic iron-cobalt catalysts: A density functional theory studyTuncer, Dilan; Kızılkaya, Ali Can 
Feb-2023Hollow nano-CaCO3's VOC sensing properties: A DFT calculation and experimental assessmentsBayram, Abdullah; Farzaneh, Amir; Esrafili, Mehdi D.; Okur, Salih ; Özdemir, Ekrem 
Apr-2022Mechanistic insights into the effect of sulfur on the selectivity of cobalt-catalyzed Fischer–Tropsch Synthesis: A DFT studyDağa, Yağmur; Kızılkaya, Ali Can