Irina Piyanzina

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

Density functional theory calculations on azobenzene derivatives: a comparative study of functional group effect

Irina Piyanzina, Benoît Minisini, Jean‐François Bardeau · Journal of Molecular Modeling · 2015 · 39 citations

Natural Sciences, Chemistry, Physics +14

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

Two-dimensional electron gas at the interface of Ba0.8Sr0.2TiO3 ferroelectric and LaMnO3 antiferomagnet

Irina Piyanzina, A. M. Balbashov, D. A. Tayurskiı̆ · Journal of Experimental and Theoretical Physics Letters · 2017 · 29 citations

Natural Sciences, Materials Science, Physics +16