Theoretical modeling of organohalide perovskites for photovoltaic applications
Structure and thermodynamic properties of hybrid perovskites by classical molecular dynamics / Alessandro Mattoni, Alessio Filippetti, Claudia Caddeo -- Intrinsic electronic, optical, and recombination properties described by the Density Functional Theory calculations / Claudia Caddeo, Alessandro Ma...
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| Format: | UnknownFormat |
| Sprache: | eng |
| Veröffentlicht: |
Boca Raton, London, New York
CRC Press, Taylor & Francis Group
2017
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| Online Zugang: | Inhaltsverzeichnis |
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Tag hinzufügen | Zusammenfassung: | Structure and thermodynamic properties of hybrid perovskites by classical molecular dynamics / Alessandro Mattoni, Alessio Filippetti, Claudia Caddeo -- Intrinsic electronic, optical, and recombination properties described by the Density Functional Theory calculations / Claudia Caddeo, Alessandro Mattoni, and Alessio Filippetti -- Hybrid organic-inorganic halide perovskites: electronic structure, dielectric properties, native defects, and the role of ns² ions / Mao-Hua Du -- Extremely slow changes in photoluminescence and Raman in organohalide hybrid perovskites: a first principle investigation / Claudio Quarti, Edoardo Mosconi, Giulia Grancini, Filippo De Angelis -- Ferroelectricity and spin-orbit coupling in organic-inorganic perovskite halides / Domenico Di Sante, Alessandro Stroppa, Liang Z. Tan, Paolo Barone, Andrew M. Rappe, Silvia Picozzi -- Alloys and environmental related issues: towards the computational design of Pb-free and stable hybrid materials for solar cells / Fedwa El Mellouhi, Fahhad H. Alharbi, Carlo Motta, Sergey Rashkeev, Stefano Sanvito, Sabre Kais -- Atomic structures and electronic states at the surfaces and interfaces of CH3NH3PbI3 perovskite / Jun Haruyama, Keitaro Sodeyama, Yoshitaka Tateyama -- Computational high-throughput screening for solar energy materials / Ivano E. Castelli, Kristian S. Thygesen, Karsten W. Jacobsen -- Organic-inorganic halide perovskite quasi-particles nature analysis via the interplay among classic solid state concepts, density functional, and many body perturbation theory / J. Even, G. Giorgi, C. Katan, H. Kawai, K. Yamashita |
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| Beschreibung: | Includes bibliographical references and index |
| Beschreibung: | xiv, 229 Seiten Illustrationen, Diagramme 27 cm |
| ISBN: | 1498750788 1-4987-5078-8 9781498750783 978-1-4987-5078-3 |