Oleg V. Nedopekin

DFT insight into Cd2+, Hg2+, Pb2+, Sn2+, As3+, Sb3+, and Cr3+ heavy metal ions adsorption onto surface of bowl-like B30 nanosheet

Sadegh Kaviani, D. A. Tayurskiı̆, Oleg V. Nedopekin et al. · Journal of Molecular Liquids · 2022 · 49 citations

Natural Sciences, Chemistry, Materials Science +14

A DFT-D3 investigation on Li, Na, and K decorated C6O6Li6 cluster as a new promising hydrogen storage system

Sadegh Kaviani, Irina Piyanzina, Oleg V. Nedopekin et al. · International Journal of Hydrogen Energy · 2023 · 45 citations

Natural Sciences, Materials Engineering, Materials Science +16

Adsorption behavior and sensing properties of toxic gas molecules onto PtnBe (n = 5, 7, 10) clusters: A DFT benchmark study

Sadegh Kaviani, Irina Piyanzina, Oleg V. Nedopekin et al. · Materials Today Communications · 2022 · 31 citations

Natural Sciences, Chemistry, Physics +16

Chitosan-based adsorptive membrane modified by carboxymethyl cellulose for heavy metal ion adsorption: Experimental and density functional theory investigations

Mohammad Khajavian, Sadegh Kaviani, Irina Piyanzina et al. · International Journal of Biological Macromolecules · 2023 · 26 citations

Engineering, Chemical Engineering, Materials Science +17

Enhanced anodic performance of CTF0 monolayer for Li-ion batteries through F and Si co-doping: A DFT insight

Sadegh Kaviani, Aigul Shamsieva, Irina Piyanzina et al. · Colloids and Surfaces A Physicochemical and Engineering Aspects · 2024 · 26 citations

Natural Sciences, Materials Engineering, Materials Science +17