An ab initio investigation on the electronic structure, defect energetics, and magnesium kinetics in Mg3Bi2

Topological Type-II Nodal Line Semimetal and Dirac Semimetal State in Stable Kagome Compound Mg3Bi2

(2017) Xiaoming Zhang et al.   Journal of Physical Chemistry Letters

Thermoelectric properties of AMg2X2, AZn2Sb2 (A = Ca, Sr, Ba; X = Sb, Bi), and Ba2ZnX2 (X = Sb, Bi) Zintl compounds

(2017) Jifeng Sun et al.   Journal of Materials Chemistry A

Resolution of the Band Gap Prediction Problem for Materials Design

(2016) Jason M. Crowley et al.   Journal of Physical Chemistry Letters

Spin-orbit coupling enhanced superconductivity in Bi-rich compounds ABi3 (A = Sr and Ba)

(2016) D. F. Shao et al.   Scientific Reports

Mapping Structural Changes in Electrode Materials: Application of the Hybrid Eigenvector-Following Density Functional Theory (DFT) Method to Layered Li0.5MnO2

(2015) Ieuan D. Seymour et al.   CHEMISTRY OF MATERIALS

A Porous Electrode Model for the Magnesiation and Demagnesiation of a Bismuth Electrode in Rechargeable Magnesium-Ion Cells

(2015) Mayandi Ramanathan et al.   JOURNAL OF THE ELECTROCHEMICAL SOCIETY

Insight into the electrochemical behavior of micrometric Bi and Mg3Bi2 as high performance negative electrodes for Mg batteries

(2015) Fabrizio Murgia et al.   Journal of Materials Chemistry A

Designing the next generation high capacity battery electrodes

(2014) H.-C. Yu et al.   Energy & Environmental Science

Influence of Defects on the Photocatalytic Activity of ZnO

(2014) Daimei Chen et al.   Journal of Physical Chemistry C

The rechargeable revolution: A better battery

(2014) Richard Van Noorden   NATURE

Revealing lithium–silicide phase transformations in nano-structured silicon-based lithium ion batteries via in situ NMR spectroscopy

(2014) K. Ogata et al.   Nature Communications

Magnesium batteries: Current state of the art, issues and future perspectives

(2014) Rana Mohtadi et al.   Beilstein Journal of Nanotechnology

On the Thermoelectric Properties of Zintl Compounds Mg3Bi2−x Pn x (Pn = P and Sb)

(2013) V. Ponnambalam et al.   JOURNAL OF ELECTRONIC MATERIALS

Highly Reversible Mg Insertion in Nanostructured Bi for Mg Ion Batteries

(2013) Yuyan Shao et al.   NANO LETTERS

A high energy-density tin anode for rechargeable magnesium-ion batteries

(2012) Nikhilendra Singh et al.   CHEMICAL COMMUNICATIONS

Density functional theory study of the structural and electronic properties of Mg3Bi2in hexagonal and cubic phases

(2012) Matin Sedighi et al.   EUROPEAN PHYSICAL JOURNAL-APPLIED PHYSICS

Electrodeposited Bi, Sb and Bi1-xSbx alloys as anodes for Mg-ion batteries

(2011) Timothy S. Arthur et al.   ELECTROCHEMISTRY COMMUNICATIONS

Relativity and the Lead-Acid Battery

(2011) Rajeev Ahuja et al.   PHYSICAL REVIEW LETTERS

Investigation of the Conversion Reaction Mechanisms for Binary Copper(II) Compounds by Solid-State NMR Spectroscopy and X-ray Diffraction

(2009) Naoko Yamakawa et al.   CHEMISTRY OF MATERIALS

Spin-orbit interaction effect in the electronic structure of Bi2Te3 observed by angle-resolved photoemission spectroscopy

(2008) H.-J. Noh et al.   EPL

Ab-initiosimulations of materials using VASP: Density-functional theory and beyond

(2008) Jürgen Hafner   JOURNAL OF COMPUTATIONAL CHEMISTRY