MOHEBBI, Elaheh
MOHEBBI, Elaheh
Dipartimento Scienze e Ingegneria della Materia, dell'Ambiente ed Urbanistica
Density functional theory and molecular dynamics studies on electrical, mechanical, and thermal properties of TiO2 nanoparticles interacting with poly lactic-co-glycolic acid
2023-01-01 Laudadio, Emiliano; Mohebbi, Elaheh; Pavoni, Eleonora; Minnelli, Cristina; Sabbatini, Simona; Stipa, Pierluigi
Effect of different pseudopotentials on the phonon frequencies, dielectric constant, and Born effective charge of SnSe and SnSe2 nanostructures: A density functional perturbation theory study
2023-01-01 Mohebbi, Elaheh; Pavoni, Eleonora; Pierantoni, Luca; Stipa, Pierluigi; Laudadio, Emiliano; Mencarelli, Davide
First-Principles Calculation of MoO2 and MoO3 Electronic and Optical Properties Compared with Experimental Data
2023-01-01 Pavoni, Eleonora; Modreanu, MIRCEA GABRIEL; Mohebbi, Elaheh; Mencarelli, Davide; Stipa, Pierluigi; Laudadio, Emiliano; Pierantoni, Luca
First-principles investigation of interface phenomena in hafnium-based metal–insulator–metal diodes
2023-01-01 Pavoni, Eleonora; Mohebbi, Elaheh; Stipa, Pierluigi; Pierantoni, Luca; Mencarelli, Davide; Dragoman, Mircea; Aldrigo, Martino; Laudadio, Emiliano
Insights into first-principles characterization of the monoclinic VO2(B) polymorph via DFT + U calculation: electronic, magnetic and optical properties
2022-01-01 Mohebbi, Elaheh; Pavoni, Eleonora; Mencarelli, Davide; Stipa, Pierluigi; Pierantoni, Luca; Laudadio, Emiliano
PBEsol/HSE Functional: A promising candidate for Vanadium dioxide (B) characterization
2022-01-01 Mohebbi, Elaheh; Pavoni, Eleonora; Mencarelli, Davide; Stipa, Pierluigi; Pierantoni, Luca; Laudadio, Emiliano
Stability, phonon calculations, electronic structure, and optical properties of a VO2(M) nanostructure: A comprehensive density functional theory study
2023-01-01 Mohebbi, Elaheh; Pavoni, Eleonora; Mencarelli, Davide; Stipa, Pierluigi; Laudadio, Emiliano; Pierantoni, Luca
The Effect of Y Doping on Monoclinic, Orthorhombic, and Cubic Polymorphs of HfO2: A First Principles Study
2022-01-01 Pavoni, Eleonora; Mohebbi, Elaheh; Mencarelli, Davide; Stipa, Pierluigi; Laudadio, Emiliano; Pierantoni, Luca
The Role of Zr on Monoclinic and Orthorhombic HfxZryO2 Systems: A First-Principles Study
2022-01-01 Pavoni, Eleonora; Mohebbi, Elaheh; Stipa, Pierluigi; Mencarelli, Davide; Pierantoni, Luca; Laudadio, Emiliano
| Titolo | Data di pubblicazione | Autore(i) | File |
|---|---|---|---|
| Density functional theory and molecular dynamics studies on electrical, mechanical, and thermal properties of TiO2 nanoparticles interacting with poly lactic-co-glycolic acid | 1-gen-2023 | Laudadio, Emiliano; Mohebbi, Elaheh; Pavoni, Eleonora; Minnelli, Cristina; Sabbatini, Simona; Stipa, Pierluigi | |
| Effect of different pseudopotentials on the phonon frequencies, dielectric constant, and Born effective charge of SnSe and SnSe2 nanostructures: A density functional perturbation theory study | 1-gen-2023 | Mohebbi, Elaheh; Pavoni, Eleonora; Pierantoni, Luca; Stipa, Pierluigi; Laudadio, Emiliano; Mencarelli, Davide | |
| First-Principles Calculation of MoO2 and MoO3 Electronic and Optical Properties Compared with Experimental Data | 1-gen-2023 | Pavoni, Eleonora; Modreanu, MIRCEA GABRIEL; Mohebbi, Elaheh; Mencarelli, Davide; Stipa, Pierluigi; Laudadio, Emiliano; Pierantoni, Luca | |
| First-principles investigation of interface phenomena in hafnium-based metal–insulator–metal diodes | 1-gen-2023 | Pavoni, Eleonora; Mohebbi, Elaheh; Stipa, Pierluigi; Pierantoni, Luca; Mencarelli, Davide; Dragoman, Mircea; Aldrigo, Martino; Laudadio, Emiliano | |
| Insights into first-principles characterization of the monoclinic VO2(B) polymorph via DFT + U calculation: electronic, magnetic and optical properties | 1-gen-2022 | Mohebbi, Elaheh; Pavoni, Eleonora; Mencarelli, Davide; Stipa, Pierluigi; Pierantoni, Luca; Laudadio, Emiliano | |
| PBEsol/HSE Functional: A promising candidate for Vanadium dioxide (B) characterization | 1-gen-2022 | Mohebbi, Elaheh; Pavoni, Eleonora; Mencarelli, Davide; Stipa, Pierluigi; Pierantoni, Luca; Laudadio, Emiliano | |
| Stability, phonon calculations, electronic structure, and optical properties of a VO2(M) nanostructure: A comprehensive density functional theory study | 1-gen-2023 | Mohebbi, Elaheh; Pavoni, Eleonora; Mencarelli, Davide; Stipa, Pierluigi; Laudadio, Emiliano; Pierantoni, Luca | |
| The Effect of Y Doping on Monoclinic, Orthorhombic, and Cubic Polymorphs of HfO2: A First Principles Study | 1-gen-2022 | Pavoni, Eleonora; Mohebbi, Elaheh; Mencarelli, Davide; Stipa, Pierluigi; Laudadio, Emiliano; Pierantoni, Luca | |
| The Role of Zr on Monoclinic and Orthorhombic HfxZryO2 Systems: A First-Principles Study | 1-gen-2022 | Pavoni, Eleonora; Mohebbi, Elaheh; Stipa, Pierluigi; Mencarelli, Davide; Pierantoni, Luca; Laudadio, Emiliano |