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Literature DB >> 21284072

Towards polycyclic aromatic hydrocarbons with a singlet open-shell ground state.

Christoph Lambert¹.

Abstract

Entities: Chemical

Year: 2011 PMID： 21284072 DOI： 10.1002/anie.201006705

Source DB: PubMed Journal: Angew Chem Int Ed Engl ISSN： 1433-7851 Impact factor: 15.336

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8 in total

1. Evaluation of modern DFT functionals and G3n-RAD composite methods in the modelization of organic singlet diradicals.

Authors: Diego López-Carballeira; Fernando Ruipérez
Journal: J Mol Model Date: 2016-03-12 Impact factor: 1.810

2. Polyradical Character of Triangular Non-Kekulé Structures, Zethrenes, p-Quinodimethane-Linked Bisphenalenyl, and the Clar Goblet in Comparison: An Extended Multireference Study.

Authors: Anita Das; Thomas Müller; Felix Plasser; Hans Lischka
Journal: J Phys Chem A Date: 2016-02-25 Impact factor: 2.781

Review 3. Nonlinear optical properties in open-shell molecular systems.

Authors: Masayoshi Nakano; Benoît Champagne
Journal: Wiley Interdiscip Rev Comput Mol Sci Date: 2016-02-25

4. Luminescent Mono-, Di-, and Triradicals: Bridging Polychlorinated Triarylmethyl Radicals by Triarylamines and Triarylboranes.

Authors: Yohei Hattori; Evripidis Michail; Alexander Schmiedel; Michael Moos; Marco Holzapfel; Ivo Krummenacher; Holger Braunschweig; Ulrich Müller; Jens Pflaum; Christoph Lambert
Journal: Chemistry Date: 2019-11-19 Impact factor: 5.236

5. Essential Role of Triplet Diradical Character for Large Magnetoresistance in Quinoidal Organic Semiconductor with High Electron Mobility.

Authors: Chao Wang; Hua Hao; Keisuke Tajima
Journal: Adv Sci (Weinh) Date: 2022-03-28 Impact factor: 17.521

Towards polycyclic aromatic hydrocarbons with a singlet open-shell ground state.

1. Evaluation of modern DFT functionals and G3n-RAD composite methods in the modelization of organic singlet diradicals.

2. Polyradical Character of Triangular Non-Kekulé Structures, Zethrenes, p-Quinodimethane-Linked Bisphenalenyl, and the Clar Goblet in Comparison: An Extended Multireference Study.

Review 3. Nonlinear optical properties in open-shell molecular systems.

4. Luminescent Mono-, Di-, and Triradicals: Bridging Polychlorinated Triarylmethyl Radicals by Triarylamines and Triarylboranes.

5. Essential Role of Triplet Diradical Character for Large Magnetoresistance in Quinoidal Organic Semiconductor with High Electron Mobility.

6. Hexa-peri-benzocoronene with two extra K-regions in an ortho-configuration.

7. The multiradical character of one- and two-dimensional graphene nanoribbons.

8. A method for controlling the synthesis of stable twisted two-dimensional conjugated molecules.