Opening book details…
About this book
Accurate predictions of the electronic excited states of BODIPY based dye sensitizers using spin-component-scaled double-hybrid functionals: a TD-DFT benchmark study by Qabas Alkhatib & Wissam Helal & Ali Marashdeh is a book available to read on EtoBox.
- Author
- Qabas Alkhatib & Wissam Helal & Ali Marashdeh
- Publisher
- Royal Society of Chemistry
- Language
- EN
More by Qabas Alkhatib & Wissam Helal & Ali Marashdeh
Browse all works by Qabas Alkhatib & Wissam Helal & Ali Marashdeh
Similar books
- New organic dye-sensitized solar cells based on the D–A–π–A structure for efficient DSSCs: DFT/TD-DFT investigations — Ahmed Azaid & Marzouk Raftani & Marwa Alaqarbeh & Rchid Kacimi & Tayeb Abram & Youness Khaddam & Diae Nebbach & Abdelouahid Sbai & Tahar Lakhlifi & Mohammed Bouachrine
- Tailoring benzo[α]phenoxazine moiety for efficient photosensitizers in dye sensitized solar cells via the DFT/TD-DFT method — Suprabha S. Sahoo & Manilal Murmu & Priyabrata Banerjee & Habib M. Pathan & Sunita Salunke-Gawali
- Fast and Accurate Excited States Predictions: Machine Learning and Diabatization — #x160; t & #x11B; p & #xE1; n Sr & #x161; e & #x148; & O. Anatole von Lilienfeld & Petr Slav & #xED; & #x10D; ek
- TD-DFT Benchmark for UV-visible Spectra of Fused-ring Electron Acceptors Using Global and Range-separated Hybrids — Amjad Ali & Muhammad Imran Rafiq & Zhuohan Zhang & Jinru Cao & Renyong Geng & Baojing Zhou & Weihua Tang
- Study of the Structural and Optoelectronic Properties of Dye Solar Cells Based on Phosphonic Acid Anchoring by DFT Functionals — Driss Fadili & Si Mohamed Bouzzine & Mohamed Hamidi
- Excited State Potential Energy Surfaces of N-phenylpyrrole Upon Twisting: Reference Values and Comparison Between BSE/GW and TD-DFT — Iryna Knysh & Kelvine Letellier & Ivan Duchemin & Xavier Blase & Denis Jacquemin