共 42 条
- [33] Theoretical X-Ray Photoelectron and Emission Spectra of C-, N-, and O-Containing Polymers by Density-Functional Theory Calculations using Model Molecules Polymer Journal, 2000, 32 : 1030 - 1037
- [36] Polyanionic identity of Ca2Zn2(V3O10)(VO4) photocatalyst manifested by X-ray powder diffraction and periodic boundary density functional theory calculations CRYSTENGCOMM, 2015, 17 (40): : 7772 - 7777
- [38] Iron behavior during the continuous phase transition of iron-doped titanium dioxide determined via high-temperature in-situ X-ray diffraction, rietveld refinement, and density functional theory studies JOURNAL OF MATERIALS RESEARCH AND TECHNOLOGY-JMR&T, 2023, 23 : 2426 - 2439