Ab initio Calculation Tutorial : For Materials Analysis, Informatics and Design / / by Ryo Maezono |
Autore | Maezono Ryo |
Edizione | [1st ed. 2023.] |
Pubbl/distr/stampa | Singapore : , : Springer Nature Singapore : , : Imprint : Springer, , 2023 |
Descrizione fisica | 1 online resource (285 pages) |
Disciplina | 780 |
Soggetto topico |
Density functionals
Materials science - Data processing Electronic structure Quantum chemistry - Computer programs Materials Chemistry Computer simulation Density Functional Theory Electronic Structure Calculations Computational Materials Science Computational Design Of Materials |
ISBN | 9789819909193 |
Formato | Materiale a stampa |
Livello bibliografico | Monografia |
Lingua di pubblicazione | eng |
Nota di contenuto | Introduction -- Preparing tutorial environments -- Sequence of computational procedure -- Determining computational conditions -- Points to understand in background theories. . |
Record Nr. | UNINA-9910726296303321 |
Maezono Ryo | ||
Singapore : , : Springer Nature Singapore : , : Imprint : Springer, , 2023 | ||
Materiale a stampa | ||
Lo trovi qui: Univ. Federico II | ||
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Recent Advances in Nanomaterials : Select Proceedings of ICNOC 2022 / / edited by Zishan Husain Khan, Mark Jackson, Numan A. Salah |
Autore | Khan Zishan Husain |
Edizione | [1st ed. 2024.] |
Pubbl/distr/stampa | Singapore : , : Springer Nature Singapore : , : Imprint : Springer, , 2024 |
Descrizione fisica | 1 online resource (581 pages) |
Disciplina | 620.11 |
Altri autori (Persone) |
JacksonMark
SalahNuman A |
Collana | Springer Proceedings in Materials |
Soggetto topico |
Materials
Chemistry Computer simulation Metals Electronics - Materials Computational Design Of Materials Metals and Alloys Electronic Materials |
ISBN | 981-9948-78-9 |
Formato | Materiale a stampa |
Livello bibliografico | Monografia |
Lingua di pubblicazione | eng |
Nota di contenuto | Investigation of Microstructural, Optical, and Electronic Properties of Hydrothermally Synthesized MoS2 Decorated SnO2 -- Synthesis of Titania Nanoparticles and Assessment of Anti-Oxidant Activity -- Structural and Magnetic Studies of Nanocrystalline La0.8-xAg0.2BixMnO3(x = 0, 0.05) -- Synthesis of Polymeric Nanoparticles Encapsulating Extract of Datura Stramonium and Study of its Various In-Vitro Activities -- Synthesis, Characterization, and Various In-Vitro Activities of Essential Oil Loaded Polymeric Nanoformulations -- Energy Gap Dependence on the Hydrostatic Pressure and Temperature of GaAs Quantum Wire -- Effect of Annealing Temperature on Microstructural, Optical and Magnetic Properties of Spinel-ZnFe2O4 Nano Particles -- Studies on Zinc Oxide Thin Film and Nanoparticles Synthesized by Chemical Bath Deposition -- Down Conversion Fluorescence Study of Non-Metal co-Doped Carbon Dots -- Green Synthesis of Carbon Dot (CDS) and Sensing of Metal Ion. |
Record Nr. | UNINA-9910765476703321 |
Khan Zishan Husain | ||
Singapore : , : Springer Nature Singapore : , : Imprint : Springer, , 2024 | ||
Materiale a stampa | ||
Lo trovi qui: Univ. Federico II | ||
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