Journal of Alloys and Compounds, Journal Year: 2025, Volume and Issue: unknown, P. 179959 - 179959
Published: March 1, 2025
Language: Английский
Journal of Alloys and Compounds, Journal Year: 2025, Volume and Issue: unknown, P. 179959 - 179959
Published: March 1, 2025
Language: Английский
Journal of Fluorescence, Journal Year: 2025, Volume and Issue: unknown
Published: Feb. 20, 2025
With the pressure for renewable energy resources and enchantingly digitalized current lifestyle, need batteries will augment. Therefore, in this article, it has been evaluated promising alternative alkali metals of sodium-ion potassium-ion, batteries. The hypothesis hydrogen adsorption phenomenon was confirmed by density distributions charge differences (CDD), total state (TDOS), electron localization function (ELF) Li[GeO-SiO], Na[GeO-SiO] or K[GeO-SiO] heterostructures that have revealed an efficient transfer owing to internal electric field. Regardless configurations H2 molecules, region variation is mainly concentrated between molecule layers atoms. maximum TDOS with several peaks around -0.35, -0.45, -0.6 -0.75 a.u. ≈ 23 -0.35 revealed. As advantages lithium, sodium potassium over Si/Ge possess its higher hole motion, allowing instruments operate at frequencies than instruments. K[GeO-SiO]-2H2 Na[GeO-SiO]-2H2 band gap 0.9230 0.8963 eV, respectively can be more grabbing. findings suggest proposed offer appropriate edge positions saving Furthermore, calculations non-magnetic dopants induce stable half-metallic ferromagnetic ground Li/Na/K. In particular, same levels doping, K/Na-doped [GeO-SiO] heterostructure framework exhibited strongest binding.
Language: Английский
Citations
1Journal of Alloys and Compounds, Journal Year: 2025, Volume and Issue: unknown, P. 179959 - 179959
Published: March 1, 2025
Language: Английский
Citations
0