4.5 Article

First-principles studies of the two-dimensional 1H-BeP2 as an electrode material for rechargeable metal ion (Li plus , Na plus , K plus ) batteries

Related references

Note: Only part of the references are listed.
Article Chemistry, Physical

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

Meiqian Wan et al.

Summary: The feasibility of BeB2 and MgB2 monolayers as anode materials for Li-ion batteries was investigated. The results showed that these monolayers exhibit good electrical conductivity, cycle stability, and high storage capacity.

JOURNAL OF PHYSICAL CHEMISTRY C (2022)

Article Chemistry, Physical

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

Nabil Khossossi et al.

Summary: Flexible electrochemical energy storage systems have great potential for portable self-powered electronic devices, and 2D lightweight and flexible materials show promise as ideal battery electrodes. The study finds that the new 2D o-B2N2 monolayer has the capability to be an ideal flexible anode material for Lithium and Sodium-ion batteries.

NANO ENERGY (2022)

Article Chemistry, Physical

Single Ni atom embedded Janus WSSe monolayer as a cost-effective electrocatalyst for oxygen evolution reaction

Jia-Xing Guo et al.

Summary: Designing cost-effective electrocatalysts for oxygen evolution reaction (OER) is crucial for efficient water splitting. In this study, a series of new OER electrocatalysts (Fe-, Co-, and Ni-WSSe) were designed using first-principles methods. By embedding single Fe, Co, and Ni atoms in Janus WSSe monolayer, the structural, electronic, and magnetic properties of the systems were significantly modified. The Ni-WSSe catalyst showed the highest catalytic activity for OER due to the synergistic effect between the Ni atom and the Janus WSSe monolayer.

MOLECULAR CATALYSIS (2022)

Article Energy & Fuels

Antimonene Allotropes α- and β-Phases as Promising Anchoring Materials for Lithium-Sulfur Batteries

Deobrat Singh et al.

Summary: The study found that pristine alpha-Sb and beta-Sb exhibited strong physisorption/chemisorption interactions with lithium polysulfides, with the binding strength enhanced by vacancies or substitution of Sb atoms. Beta-Sb monolayers, both pristine and defected, were identified as potential excellent anchoring materials for Li-S batteries.

ENERGY & FUELS (2021)

Review Chemistry, Multidisciplinary

Emerging Applications of Elemental 2D Materials

Nicholas R. Glavin et al.

ADVANCED MATERIALS (2020)

Article Chemistry, Physical

Design of tetracene-based metallic 2D carbon materials for Na- and K-Ion batteries

Umer Younis et al.

APPLIED SURFACE SCIENCE (2020)

Review Materials Science, Multidisciplinary

Two-dimensional materials as anodes for sodium-ion batteries

Y-M Chang et al.

MATERIALS TODAY ADVANCES (2020)

Article Green & Sustainable Science & Technology

Boron-graphdiyne as an anode material for Li, Na, and K ion batteries with high capacities and low diffusion barriers

Imran Muhammad et al.

JOURNAL OF RENEWABLE AND SUSTAINABLE ENERGY (2019)

Article Chemistry, Physical

Inquisitive Geometric Sites in h-BN Monolayer for Alkali Earth Metal Ion Batteries

Shivam Kansara et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2019)

Article Nanoscience & Nanotechnology

Two-Dimensional Penta-BN2 with High Specific Capacity for Li-Ion Batteries

Ting Zhang et al.

ACS APPLIED MATERIALS & INTERFACES (2019)

Article Physics, Applied

Net W monolayer: A high-performance electrode material for Li-ion batteries

Song Yu et al.

APPLIED PHYSICS LETTERS (2018)

Article Nanoscience & Nanotechnology

Adsorption and diffusion of mono, di, and trivalent ions on two-dimensional TiS2

Abdus Samad et al.

NANOTECHNOLOGY (2017)

Article Chemistry, Physical

Atomically dispersed Co atoms on MoS2 monolayer: A promising high-activity catalyst for CO oxidation

Shangguo Liu et al.

APPLIED SURFACE SCIENCE (2017)

Article Chemistry, Physical

Ab Initio Prediction and Characterization of Mo2C Monolayer as Anodes for Lithium-Ion and Sodium-Ion Batteries

Qilong Sun et al.

JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2016)

Article Multidisciplinary Sciences

Origin of low sodium capacity in graphite and generally weak substrate binding of Na and Mg among alkali and alkaline earth metals

Yuanyue Liu et al.

PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2016)

Article Materials Science, Multidisciplinary

Density functional theory study of Li, Na, and Mg intercalation and diffusion in MoS2 with controlled interlayer spacing

Jing Shuai et al.

MATERIALS RESEARCH EXPRESS (2016)

Article Chemistry, Physical

Two-Dimensional MnO2 as a Better Cathode Material for Lithium Ion Batteries

Shuo Deng et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2015)

Article Chemistry, Physical

Understanding the Electrochemical Properties of Li-Rich Cathode Materials from First-Principles Calculations

Tingting Cao et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2015)

Article Nanoscience & Nanotechnology

Ti3C2 MXene as a High Capacity Electrode Material for Metal (Li, Na, K, Ca) Ion Batteries

Dequan Er et al.

ACS APPLIED MATERIALS & INTERFACES (2014)

Article Chemistry, Multidisciplinary

MoS2/Graphene Composite Paper for Sodium-Ion Battery Electrodes

Lamuel David et al.

ACS NANO (2014)

Article Chemistry, Physical

New Horizons for Conventional Lithium Ion Battery Technology

Evan M. Erickson et al.

JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2014)

Article Chemistry, Physical

Ab initio characterization of layered MoS2 as anode for sodium-ion batteries

Majid Mortazavi et al.

JOURNAL OF POWER SOURCES (2014)

Article Chemistry, Physical

Graphene-based nanocomposites for energy storage and conversion in lithium batteries, supercapacitors and fuel cells

Nasir Mahmood et al.

JOURNAL OF MATERIALS CHEMISTRY A (2014)

Review Chemistry, Multidisciplinary

Update on Na-based battery materials. A growing research path

Veronica Palomares et al.

ENERGY & ENVIRONMENTAL SCIENCE (2013)

Editorial Material Chemistry, Physical

In Charge of the World: Electrochemical Energy Storage

Arumugam Manthiram et al.

JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2013)

Article Chemistry, Multidisciplinary

Two-Dimensional Transition Metal Carbides

Michael Naguib et al.

ACS NANO (2012)

Article Chemistry, Multidisciplinary

Voltage, stability and diffusion barrier differences between sodium-ion and lithium-ion intercalation materials

Shyue Ping Ong et al.

ENERGY & ENVIRONMENTAL SCIENCE (2011)

Article Chemistry, Physical

Accurate and efficient algorithm for Bader charge integration

Min Yu et al.

JOURNAL OF CHEMICAL PHYSICS (2011)

Review Multidisciplinary Sciences

Electrical Energy Storage for the Grid: A Battery of Choices

Bruce Dunn et al.

SCIENCE (2011)

Article Chemistry, Multidisciplinary

Edge Effects on the Characteristics of Li Diffusion in Graphene

Chananate Uthaisar et al.

NANO LETTERS (2010)

Review Chemistry, Multidisciplinary

First principles computational materials design for energy storage materials in lithium ion batteries

Ying Shirley Meng et al.

ENERGY & ENVIRONMENTAL SCIENCE (2009)

Review Materials Science, Multidisciplinary

Progress in electrical energy storage system: A critical review

Haisheng Chen et al.

PROGRESS IN NATURAL SCIENCE-MATERIALS INTERNATIONAL (2009)

Article Chemistry, Physical

Optimization methods for finding minimum energy paths

Daniel Sheppard et al.

JOURNAL OF CHEMICAL PHYSICS (2008)

Article Multidisciplinary Sciences

Building better batteries

M. Armand et al.

NATURE (2008)