Browsing "04. Mühendislik Fakültesi / Faculty of Engineering" by Subject Density functional theory
Showing results 1 to 10 of 10
Issue Date | Title | Author(s) |
---|---|---|
Aug-2017 | Adsorption and diffusion characteristics of lithium on hydrogenated ?- and ß-silicene | İyikanat, Fadıl; Kandemir, Ali; Bacaksız, Cihan; Şahin, Hasan |
2023 | Atomic-scale insights into carbon dioxide hydrogenation over bimetallic iron-cobalt catalysts: A density functional theory study | Tuncer, Dilan; Kızılkaya, Ali Can |
Sep-2017 | Few-layer MoS2 as nitrogen protective barrier | Akbalı, Barış; Yanılmaz, Alper; Tomak, Aysel ; Tongay, Sefaattin; Çelebi, Cem ; Şahin, Hasan |
Feb-2023 | Hollow nano-CaCO3's VOC sensing properties: A DFT calculation and experimental assessments | Bayram, Abdullah; Farzaneh, Amir; Esrafili, Mehdi D.; Okur, Salih ; Özdemir, Ekrem |
Apr-2022 | Mechanistic insights into the effect of sulfur on the selectivity of cobalt-catalyzed Fischer–Tropsch Synthesis: A DFT study | Dağa, Yağmur; Kızılkaya, Ali Can |
2017 | Nitrogen doping for facile and effective modification of graphene surfaces | Yanılmaz, Alper; Tomak, Aysel ; Akbalı, Barış; Bacaksız, Cihan; Özçeri, Elif; Arı, Ozan ; Senger, Ramazan Tuğrul ; Selamet, Yusuf ; Zareie, Hadi M. |
2020 | Orthorhombic CsPbI3 perovskites: Thickness-dependent structural, optical and vibrational properties | Özen, Sercan; İyikanat, Fadıl; Özcan, Mehmet; Tekneci, Gülsüm Efsun; Eren, İsmail ; Sözen, Yiğit ; Şahin, Hasan |
2020 | Parametrizing nonbonded interactions between silica and water from first principles | Özçelik, H. Gökberk; Sözen, Yiğit ; Şahin, Hasan ; Barışık, Murat |
2017 | ?-Silicene as oxidation-resistant ultra-thin coating material | Kandemir, Ali; İyikanat, Fadıl; Bacaksız, Cihan; Şahin, Hasan |
Jul-2016 | Structural changes in a Schiff base molecular assembly initiated by scanning tunneling microscopy tip | Tomak, Aysel ; Bacaksız, Cihan; Mendirek, Gizem; Şahin, Hasan ; Hür, Deniz; Görgün, Kamuran; Senger, Ramazan Tuğrul ; Birer, Özgür; Peeters, François M.; Zareie, Hadi M. |