Benchmark of Simplified Time‐Dependent Density Functional Theory for UV–Vis Spectral Properties of Porphyrinoids-Reference-Cited by-同舟云学术

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Benchmark of Simplified Time‐Dependent Density Functional Theory for UV–Vis Spectral Properties of Porphyrinoids

Published:2019-11-24 Issue:1 Volume:3 Page:1900192
ISSN:2513-0390
Container-title:Advanced Theory and Simulations
language:en
Short-container-title:Adv. Theory Simul.

Author:

Batra Kamal¹,Zahn Stefan²,Heine Thomas¹³^ORCID

Affiliation:

1. Technische Universität DresdenTheoretische Chemie Bergstraße 66c 01062 Dresden Germany

2. Leibniz Institut für Oberflächenmodifizierung (IOM) Permoserstraße 15 04318 Leipzig Germany

3. Helmholtz‐Zentrum Dresden‐Rossendorf, Forschungsstelle Leipzig Permoserstraße 15 04318 Leipzig Germany

Funder

Deutsche Forschungsgemeinschaft

Publisher

Wiley

Subject

Multidisciplinary,Modeling and Simulation,Numerical Analysis,Statistics and Probability

Link

https://onlinelibrary.wiley.com/doi/pdf/10.1002/adts.201900192

Reference94 articles.

1. Porphyrin-sensitized solar cells

2. Porphyrin-based sensor nanoarchitectonics in diverse physical detection modes

3. Manganese Porphyrin-dsDNA Complex: A Mimicking Enzyme for Highly Efficient Bioanalysis

4. Photosensitizers of the porphyrin and phthalocyanine series for photodynamic therapy

5. Photoinduced Charge-Carrier Generation in Epitaxial MOF Thin Films: High Efficiency as a Result of an Indirect Electronic Band Gap?

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4. Evaluation of using the time-dependent density functional theory in studying the fluorescence properties of coumarin derivatives;New Journal of Chemistry;2024

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