Progress in research into 2D graphdiyne-based materials

C Huang, Y Li, N Wang, Y Xue, Z Zuo, H Liu… - Chemical …, 2018 - ACS Publications
Graphynes (GYs) are carbon allotropes with single-atom thickness that feature layered 2D
structure assembled by carbon atoms with sp-and sp2-hybridization form. Various functional …

Rethinking SnSe thermoelectrics from computational materials science

S Bai, X Zhang, LD Zhao - Accounts of Chemical Research, 2023 - ACS Publications
Conspectus The growing energy crisis and the adverse environmental impacts caused by
carbon-based energy consumption have spurred the exploration of green and sustainable …

Realizing high in-plane carrier mobility in n-type SnSe crystals through deformation potential modification

H Shi, L Su, S Bai, B Qin, Y Wang, S Liu… - Energy & …, 2023 - pubs.rsc.org
Thermoelectric technology, as one solution to energy harvesting, offers a direct and
reversible conversion between electricity and heat. The emerging thermoelectric material …

[HTML][HTML] Applying Marcus theory to describe the carrier transports in organic semiconductors: Limitations and beyond

Z Shuai, W Li, J Ren, Y Jiang, H Geng - The Journal of Chemical …, 2020 - pubs.aip.org
Marcus theory has been successfully applied to molecular design for organic
semiconductors with the aid of quantum chemistry calculations for the molecular parameters …

[HTML][HTML] Thermoelectric transport properties in chalcogenides ZnX (X= S, Se): From the role of electron-phonon couplings

J Ding, C Liu, L Xi, J Xi, J Yang - Journal of Materiomics, 2021 - Elsevier
Electron-phonon coupling (EPC) is a key factor for thermoelectric properties of materials. In
this paper, the thermoelectric properties of zinc-blende chalcogenides (p-type) ZnS and …

Strong electron-phonon interaction induced significant reduction in lattice thermal conductivities for single-layer MoS2 and PtSSe

C Liu, M Yao, J Yang, J Xi, X Ke - Materials Today Physics, 2020 - Elsevier
Electron-phonon interaction (EPI) has been widely suited in electrical transport properties,
such as electrical resistivity in metals and electronic mobility in semiconductors …

Fabrication and application of graphdiyne-based heterogeneous compositions: from the view of interaction

Q Qi, L Xu, J Du, N Yang, D Wang - Chemical Research in Chinese …, 2021 - Springer
G raphdiyne (GDY) has the unique feature in the topological ordered arranged sp-and sp 2-
hybridized carbon atoms, thus deriving a series of 2D allotropes. Due to inhomogeneous π …

On the interface between biomaterials and two-dimensional materials for biomedical applications

C Du, T Du, Z Chang, C Yin, Y Cheng - Advanced Drug Delivery Reviews, 2022 - Elsevier
Abstract Two-dimensional (2D) materials have garnered significant attention due to their
ultrathin 2D structures with a high degree of anisotropy and functionality. Reliable …

Zeolite-like molecules: Promising dielectrics for two-dimensional semiconductors

L Liu, P Li, Y Zhao, H Song, T Liu, H Li, T Zhai - Science China Materials, 2023 - Springer
Abstract Two-dimensional (2D) semiconductors have opened opportunities for the
development of next-generation semiconductor devices and the continuation of Moore's law …

Calculating electron-phonon coupling matrix: Theory introduction, code development and preliminary application

YK Ye, MY Weng, WT Zhang, WC Lin, TW Chen… - Science China …, 2023 - Springer
Electron-phonon coupling (EPC) in bulk materials is an important effect in multifarious
physical and chemical phenomena. It is the key to explaining the mechanisms for …