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Transition metal-doped graphene nanoflakes for CO and CO2 storage and sensing applications: a DFT study |
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| Authors: | Promthong Niwat Tabtimsai Chanukorn Rakrai Wandee Wanno Banchob |
| Institution: | 1.Center of Excellence for Innovation in Chemistry and Supramolecular Chemistry Research Unit, Department of Chemistry, Faculty of Science, Mahasarakham University, Maha Sarakham, 44150, Thailand ;2.Computational Chemistry Center for Nanotechnology and Department of Chemistry, Faculty of Science and Technology, Rajabhat Maha Sarakham University, Maha Sarakham, 44000, Thailand ; |
| Abstract: | Structural Chemistry - The adsorptions of CO and CO2 on pristine and transition metal-doped graphene nanoflakes (GNFs) were theoretically investigated using the density functional theory. Doping of... |
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