Joliot-Curie 6
Dubna, 141980
Russia
Joint Institute for Nuclear Research
zirconium dioxide, stability, yttrium-stabilized ZrO2 (YSZ), oxygen vacancy, enthalpy and entropy, doped-induced phase transition and Fermi level shift
zirconium dioxide, stability and yttrium-stabilized ZrO2 (YSZ), oxygen vacancy, enthalpy and entropy, doped-induced phase transition and fermi level shift
solar energy materials; CZTSSe; bandgap; electronic structure; density functional theory; modified Becke–Johnson functional
Density of States; Water Adsorption; DFT; Titanium Dioxide; Water Splitting; Surface
lead-free perovskites, perovskite stabilization, stability, band gap, solar cells, perovskite solar cells, photovoltaic technology Innovation Forever Publishing Group Limited
titanium dioxide; doping, electronic properties; bandgap; quantum mechanical calculations; optical properties; visible region.
computer first-principles calculations, density function theory, thermodynamic properties, lead-free perovskites, instability, phase transitions, renewable energy, sustainable development, photovoltaic applications.
cadmium telluride; doping; density functional calculation; X-ray analyses; electronic properties; band gap; optical properties; absorption coefficient; dielectric constant
lead-free perovskites, solar cells, Phase transitions, Stable phase, Electronic and optical properties, Photovoltaic applications
immobilization of DNA molecules on the surface of dielectrics, molecular electronics, nanotechnology, modular-dynamic modeling, DNA conformation in an electric field, genotoxic effects, zirconium dioxide
Optical materials, Thin film solar cells, Kesterites, CZTSSe, Band gap, Optical properties, Photovoltaic Applications, Density functional theory, mBJ potential
lead-free perovskites; instability; phase transitions; thermodynamic characteristics; Fermi level shift; electronic and optical properties; density function theory; phonopy calculations; photovoltaic applications
zirconia; stability; yttrium-stabilized ZrO2 (YSZ); phase transition; doped-induced phase transition; Fermi level shift; oxygen vacancy; enthalpy and entropy; water adsorption on the surface
