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Computational Quantum Physics and Chemistry of Nanomaterials
| Computational Quantum Physics and Chemistry of Nanomaterials |
| Autore | Šob Mojmír |
| Pubbl/distr/stampa | Basel, Switzerland, : MDPI - Multidisciplinary Digital Publishing Institute, 2021 |
| Descrizione fisica | 1 online resource (198 p.) |
| Soggetto topico | Research & information: general |
| Soggetto non controllato |
ab initio
ab initio calculations AlN atomic cluster azobenzene BTF CL-20 cocrystal critical size CsPb2Br5 CsPbBr3 CTAB decahedron defects defects binding energies density functional theory density-functional theory DFT dye-sensitized solar cells electronic structure energetic materials environment and health excess energy fcc Ni ferroelectricity first-principles first-principles physics generalized stacking fault energy gold grain boundary energy hazardous gas high-entropy alloys HSE06 hybrid functional interfacial energy large-scale ab initio molecular dynamics simulations low-dimensional material magnetic doping magnetism molecular mechanics n/a nanoflakes nanoparticles nanoribbon phase transition segregation energy shock sensitivity Si and Al impurity silver SnTe solvent polarity surface energy TATB thermodynamics tilt Σ5(210) grain boundary topological insulators vacancy |
| Formato | Materiale a stampa  |
| Livello bibliografico | Monografia |
| Lingua di pubblicazione | eng |
| Record Nr. | UNINA-9910557583503321 |
Šob Mojmír
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| Basel, Switzerland, : MDPI - Multidisciplinary Digital Publishing Institute, 2021 | ||
| Materiale a stampa | ||
| Lo trovi qui: Univ. Federico II | ||
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Diffusionseigenschaften von Nickel in einer Festoxid-Brennstoffzelle
| Diffusionseigenschaften von Nickel in einer Festoxid-Brennstoffzelle |
| Autore | Haremski Patricia |
| Pubbl/distr/stampa | Karlsruhe, : KIT Scientific Publishing, 2022 |
| Descrizione fisica | 1 electronic resource (164 p.) |
| Collana | Schriftenreihe des Instituts für Angewandte Materialien, Karlsruher Institut für Technologie |
| Soggetto topico | Mechanical engineering & materials |
| Soggetto non controllato |
solid oxide fuel cell
grain boundary energy Festoxid-Brennstoffzelle SOFC Nickel Diffusion Korngrenzenergie |
| ISBN | 1000136273 |
| Formato | Materiale a stampa |
| Livello bibliografico | Monografia |
| Lingua di pubblicazione | ger |
| Record Nr. | UNINA-9910547687703321 |
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Haremski Patricia
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| Karlsruhe, : KIT Scientific Publishing, 2022 | ||
| Materiale a stampa | ||
| Lo trovi qui: Univ. Federico II | ||
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