Strain-induced Dirac cone-like electronic structures and semiconductor–semimetal transition in graphdiyne

Literature Information

Publication Date 2013-03-22
DOI 10.1039/C3CP44457K
Impact Factor 3.676
Authors

Hui-Juan Cui, Xian-Lei Sheng, Qing-Bo Yan, Qing-Rong Zheng, Gang Su


View Original

Abstract

By means of first-principles calculations combined with the tight-binding approximation, the strain-induced semiconductor–semimetal transition in graphdiyne is discovered. It is shown that the band gap of graphdiyne increases from 0.47 eV to 1.39 eV with increasing the biaxial tensile strain, while the band gap decreases from 0.47 eV to nearly zero with increasing the uniaxial tensile strain, and Dirac cone-like electronic structures are observed. The uniaxial strain-induced changes of the electronic structures of graphdiyne come from the breaking of geometrical symmetry that lifts the degeneracy of energy bands. The properties of graphdiyne under strains are found to differ remarkably from that of graphene.

Related Literature

Protein hydration in living cells probed by Fourier transform infrared (FT-IR) spectroscopic imaging

B. Turner, J. Mizukado, S. G. Kazarian

2017-05-15 Paper

DOI: 10.1039/C7AN00337D

Correction: Redox-responsive, reversibly fluorescent nanoparticles from sustainable cellulose derivatives

Wei Wang, Wei Li, Kai Zhang

2015-04-22 Correction

DOI: 10.1039/C5TA90092A

Receptor-targeting fluorescence imaging and theranostics using a graphene oxide based supramolecular glycocomposite

Ding-Kun Ji, Yi Zang, Wang Liu, Xiongwen Zhang, Jia Li, Guo-Rong Chen, Tony D. James, Xiao-Peng He

2015-11-06 Paper

DOI: 10.1039/C5TB02057C

Correction: High-resolution DNA size enrichment using a magnetic nano-platform and application in non-invasive prenatal testing

Hao Wan, Ying Liu, Haiyan Zhang, Linghua Zeng, Jiale Qu, Ben-Qing Wu, Xinhong Wan

2022-01-06 Correction

DOI: 10.1039/D1AN90111G

A rapid and highly sensitive paper-based colorimetric device for the on-site screening of ammonia gas

Kawin Khachornsakkul, Kuen-Hau Hung, Jung-Jung Chang, Wijitar Dungchai, Chih-Hsin Chen

2021-03-02 Paper

DOI: 10.1039/D1AN00032B

Electrocatalytic monitoring of peptidic proton-wires

V. Dorčák, M. Kabeláč, O. Kroutil, K. Bednářová, J. Vacek

2016-06-15 Communication

DOI: 10.1039/C6AN00869K

Self-assembled nanomaterials for biosensing and therapeutics: recent advances and challenges

Shan Huang, Yuexin Song, Zhimei He, Jian-Rong Zhang, Jun-Jie Zhu

2021-03-10 Minireview

DOI: 10.1039/D1AN00077B

You might also like

Compound Q&A

What is the market or research trend for N-(4-Methoxybenzyl)-2-pyridinamine (CAS: 52818-63-0)?

N-(4-Methoxybenzyl)-2-pyridinamine (CAS: 52818-63-0) is increasingly being used ...

52818-63-0N-(4-Methoxybenzyl)-...
Compound Q&A

What precautions should be taken when handling Ethyl 4-(2-chlorophenyl)-1,3-thiazole-2-carboxylate (CAS: 1050507-06-6)?

When handling Ethyl 4-(2-chlorophenyl)-1,3-thiazole-2-carboxylate, appropriate p...

1050507-06-6Ethyl 4-(2-chlorophe...
Compound Q&A

What regulatory guidelines apply to diethyldiselane (CAS: 628-39-7)?

Diethyldiselane (CAS: 628-39-7) is classified under the Globally Harmonized Syst...

628-39-7Diethyldiselane
Compound Q&A

What is the market or research trend for oxocopper (CAS: 12053-18-8)?

The market for oxocopper (CAS: 12053-18-8) is primarily driven by its use in cat...

12053-18-8oxocopper; oxo-(oxoc...
Compound Q&A

What is the market or research trend for 5-{[(2-Methyl-2-propanyl)oxy]carbonyl}-5-azaspiro[2.4]heptane-7-carboxylic acid?

The market for 5-{[(2-Methyl-2-propanyl)oxy]carbonyl}-5-azaspiro[2.4]heptane-7-c...

1268519-54-55-{[(2-Methyl-2-prop...
Compound Q&A

What is 2-(1-Pyrrolidinyl)-4-pyridinamine (CAS: 35981-63-6)?

2-(1-Pyrrolidinyl)-4-pyridinamine is a chemical compound with the CAS number 359...

35981-63-62-(1-Pyrrolidinyl)-4...
Compound Q&A

What are the physical and chemical properties of 2-(3-Pyridinyl)-1-azabicyclo[2.2.2]octane (CAS: 91556-75-1)?

2-(3-Pyridinyl)-1-azabicyclo[2.2.2]octane (CAS: 91556-75-1) is a crystalline sol...

91556-75-12-(3-Pyridinyl)-1-az...
Compound Q&A

How is (S)-Alpha-allyl-proline hydrochloride (CAS: 129704-91-2) typically synthesized?

(S)-Alpha-allyl-proline hydrochloride is usually synthesized via a Wittig reacti...

129704-91-2(S)-Alpha-allyl-prol...
Compound Q&A

What is 3-Methyl-1,2-oxazole-5-carboxylic acid (CAS: 4857-42-5)?

3-Methyl-1,2-oxazole-5-carboxylic acid (CAS: 4857-42-5) is an organic compound w...

4857-42-53-Methyl-1,2-oxazole...
Compound Q&A

How is Lys-SMCC-DM1 (CAS: 1281816-04-3) typically synthesized?

Lys-SMCC-DM1 is synthesized via a multi-step process involving the coupling of S...

1281816-04-3Lys-SMCC-DM1

Source Journal

Physical Chemistry Chemical Physics

Physical Chemistry Chemical Physics
CiteScore: 5.5
Self-citation Rate: 10.3%
Articles per Year: 3036

Physical Chemistry Chemical Physics (PCCP) is an international journal co-owned by 19 physical chemistry and physics societies from around the world. This journal publishes original, cutting-edge research in physical chemistry, chemical physics and biophysical chemistry. To be suitable for publication in PCCP, articles must include significant innovation and/or insight into physical chemistry; this is the most important criterion that reviewers and Editors will judge against when evaluating submissions. The journal has a broad scope and welcomes contributions spanning experiment, theory, computation and data science. Topical coverage includes spectroscopy, dynamics, kinetics, statistical mechanics, thermodynamics, electrochemistry, catalysis, surface science, quantum mechanics, quantum computing and machine learning. Interdisciplinary research areas such as polymers and soft matter, materials, nanoscience, energy, surfaces/interfaces, and biophysical chemistry are welcomed if they demonstrate significant innovation and/or insight into physical chemistry. Joined experimental/theoretical studies are particularly appreciated when complementary and based on up-to-date approaches.

Recommended Suppliers

Disclaimer
This page provides academic journal information for reference and research purposes only. We are not affiliated with any journal publishers and do not handle publication submissions. For publication-related inquiries, please contact the respective journal publishers directly.
If you notice any inaccuracies in the information displayed, please contact us at support@chemtradehub.com. We will promptly review and address your concerns.