[HTML][HTML] First-principles study of sulfur atom doping and adsorption on α–Fe2O3 (0001) film

J An, P Wanaguru, C Xia, M Tao, Q Zhang - Physics Letters A, 2016 - Elsevier
Using the spin-polarized density functional theory (DFT) and the DFT+ U method, the
geometric and electronic properties of the hematite α–Fe 2 O 3 (0001) film with the sulfur (S) …

First-principles study of sulfur atom doping and adsorption on α–Fe2O3 (0001) film

J An, P Wanaguru, C Xia, M Tao, Q Zhang - Physics Letters A, 2016 - infona.pl
Using the spin-polarized density functional theory (DFT) and the DFT+ U method, the
geometric and electronic properties of the hematite α–Fe2O3 (0001) film with the sulfur (S) …

First-principles study of sulfur atom doping and adsorption on α-Fe2O3 (0001) film

J An, P Wanaguru, C Xia, M Tao… - Physics Letters A, 2016 - ui.adsabs.harvard.edu
Using the spin-polarized density functional theory (DFT) and the DFT+ U method, the
geometric and electronic properties of the hematite α-Fe 2 O 3 (0001) film with the sulfur (S) …

First-principles study of sulfur atom doping and adsorption on α–Fe2O3 (0001) film

J An, P Wanaguru, C Xia, M Tao… - Physics Letters, Section …, 2016 - asu.elsevierpure.com
Using the spin-polarized density functional theory (DFT) and the DFT+ U method, the
geometric and electronic properties of the hematite α–Fe 2 O 3 (0001) film with the sulfur (S) …