A computational study of the effects of axial halogen substitutions of boron subphthalocyanines on their electronic spectra in solution and in the solid state-Reference-Cited by-同舟云学术

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A computational study of the effects of axial halogen substitutions of boron subphthalocyanines on their electronic spectra in solution and in the solid state

Published:2019-11 Issue: Volume:222 Page:117180
ISSN:1386-1425
Container-title:Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy
language:en
Short-container-title:Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy

Author:

Li Guo,Zheng Shaohui^ORCID

Funder

Fundamental Research Funds for the Central Universities

Foundation for Returning Overseas Chinese

Young Faculty of Southwest University

Higher Education in Chongqing

Publisher

Elsevier BV

Subject

Spectroscopy,Instrumentation,Atomic and Molecular Physics, and Optics,Analytical Chemistry

Reference50 articles.

1. Open-circuit voltage exceeding the outermost HOMO-LUMO offset in cascade organic solar cells;Stevens;Org. Electron.,2016

2. Tuning up an electronic structure of the Subphthalocyanine derivatives toward electron-transfer process in noncovalent complexes with C-60 and C-70 fullerenes: experimental and theoretical studies;Rhoda;lnorg. Chem.,2016

3. Aryl-substituted boron Subphthalocyanines and their application in organic photovoltaics;Bonnier;Aust. J. Chem.,2015

4. Effect of axial halogen substitution on the performance of subphthalocyanine based organic photovoltaic cells;Morris;Org. Electron.,2014

5. The role of the axial substituent in subphthalocyanine acceptors for bulk-heterojunction solar cells;Duan;Angew. Chem. Int. Ed.,2017

Cited by 12 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. A computational investigation about the effect of metal substitutions on the electronic spectra of porphyrin donors in the visible and near infrared regions;Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy;2022-12

2. Electronic Structure, Bonding, and Stability of Boron Subphthalocyanine Halides and Pseudohalides;Advanced Theory and Simulations;2022-02-10

3. Recent advances in subphthalocyanines and related subporphyrinoids;Chemical Society Reviews;2022

4. Designing Potential Donor Materials Based on DRCN5T with Halogen Substitutions: A DFT/TDDFT Study;International Journal of Molecular Sciences;2021-12-16

5. Novel axial substituted subphthalocyanine sensitized titanium dioxide H 12 SubPcB‐OPh 2 OH/TiO 2 photocatalyst: Synthesis, density functional theory calculation, and photocatalytic properties;Applied Organometallic Chemistry;2021-04-23

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