Towards establishing standard performance metrics for batteries, supercapacitors and beyond

A Noori, MF El-Kady, MS Rahmanifar… - Chemical Society …, 2019 - pubs.rsc.org
Over the past decade, electrochemical energy storage (EES) devices have greatly improved,
as a wide variety of advanced electrode active materials and new device architectures have …

Structure prototype outperforming MXenes in stability and performance in metal‐ion batteries: a high throughput study

M Sun, U Schwingenschlögl - Advanced energy materials, 2021 - Wiley Online Library
Abstract While the MXene Ti3C2 is well known for its extraordinary material properties with
wide applications, it is demonstrated here that it is not the most stable 2D titanium carbide …

Polymorphism in post-dichalcogenide two-dimensional materials

H Bergeron, D Lebedev, MC Hersam - Chemical Reviews, 2021 - ACS Publications
Two-dimensional (2D) materials exhibit a wide range of atomic structures, compositions, and
associated versatility of properties. Furthermore, for a given composition, a variety of …

B2P6: A Two-Dimensional Anisotropic Janus Material with Potential in Photocatalytic Water Splitting and Metal-Ion Batteries

M Sun, U Schwingenschlogl - Chemistry of Materials, 2020 - ACS Publications
Both anisotropic and Janus two-dimensional materials are known for extraordinary
properties. We predict a two-dimensional material, B2P6, which combines anisotropy with …

Application of two-dimensional materials as anodes for rechargeable metal-ion batteries: A comprehensive perspective from density functional theory simulations

Y Bahari, B Mortazavi, A Rajabpour, X Zhuang… - Energy Storage …, 2021 - Elsevier
Rechargeable lithium-ion batteries (LIBs) have been serving as one the most critical
components of fast growing technologies, such as the mobile electronic and electrified …

Two-Dimensional BeB2 and MgB2 as High Capacity Dirac Anodes for Li-Ion Batteries: A DFT Study

M Wan, S Zhao, Z Zhang, N Zhou - The Journal of Physical …, 2022 - ACS Publications
The development of anode materials with good stability, high capacity, and excellent
electrical conductivity is an important challenge for high-performance Li-ion batteries …

[HTML][HTML] Two-dimensional borophene: properties, fabrication, and promising applications

Z Xie, X Meng, X Li, W Liang, W Huang, K Chen… - Research, 2020 - spj.science.org
Abstract Monoelemental two-dimensional (2D) materials (Xenes) aroused a tremendous
attention in 2D science owing to their unique properties and extensive applications …

Intermixing and periodic self-assembly of borophene line defects

X Liu, Z Zhang, L Wang, BI Yakobson, MC Hersam - Nature materials, 2018 - nature.com
Abstract Two-dimensional (2D) boron (that is, borophene) was recently synthesized
following theoretical predictions,,,–. Its metallic nature and high in-plane anisotropy combine …

Beryllene: a promising anode material for Na-and K-ion batteries with ultrafast charge/discharge and high specific capacity

M Sun, Y Yan, U Schwingenschlogl - The Journal of Physical …, 2020 - ACS Publications
We predict two-dimensional Be materials, α-and β-beryllene. In α-beryllene each Be atom
binds to six other Be atoms in a planar scheme, whereas β-beryllene consists of two stacked …

[HTML][HTML] Revealing the superlative electrochemical properties of o-B2N2 monolayer in Lithium/Sodium-ion batteries

N Khossossi, W Luo, Z Haman, D Singh, I Essaoudi… - Nano Energy, 2022 - Elsevier
Promising flexible electrochemical energy storage systems (EESSs) are currently drawing
considerable attention for their tremendous prospective end-use in portable self-powered …