Structure prediction drives materials discovery

AR Oganov, CJ Pickard, Q Zhu, RJ Needs - Nature Reviews Materials, 2019 - nature.com
Progress in the discovery of new materials has been accelerated by the development of
reliable quantum-mechanical approaches to crystal structure prediction. The properties of a …

Rise of silicene: A competitive 2D material

J Zhao, H Liu, Z Yu, R Quhe, S Zhou, Y Wang… - Progress in Materials …, 2016 - Elsevier
Silicene, a silicon analogue of graphene, has attracted increasing attention during the past
few years. As early as in 1994, the possibility of stage corrugation in the Si analogs of …

Synthesis of borophenes: Anisotropic, two-dimensional boron polymorphs

AJ Mannix, XF Zhou, B Kiraly, JD Wood, D Alducin… - Science, 2015 - science.org
At the atomic-cluster scale, pure boron is markedly similar to carbon, forming simple planar
molecules and cage-like fullerenes. Theoretical studies predict that two-dimensional (2D) …

Experimental realization of two-dimensional boron sheets

B Feng, J Zhang, Q Zhong, W Li, S Li, H Li, P Cheng… - Nature …, 2016 - nature.com
A variety of two-dimensional materials have been reported in recent years, yet single-
element systems such as graphene and black phosphorus have remained rare. Boron …

Exploring the hydrogen evolution catalytic activity of the orthorhombic and hexagonal borophene as the hydrogen storage material

E Yu, Y Pan - Electrochimica Acta, 2022 - Elsevier
Although the hydrogen evolution reaction of the triangular borophene has been studied, the
stability and hydrogen evolution reaction of the currently known borophene structure are …

[HTML][HTML] Production and processing of graphene and related materials

C Backes, AM Abdelkader, C Alonso… - 2D …, 2020 - iopscience.iop.org
We present an overview of the main techniques for production and processing of graphene
and related materials (GRMs), as well as the key characterization procedures. We adopt …

Borophene as a prototype for synthetic 2D materials development

AJ Mannix, Z Zhang, NP Guisinger, BI Yakobson… - Nature …, 2018 - nature.com
The synthesis of 2D materials with no analogous bulk layered allotropes promises a
substantial breadth of physical and chemical properties through the diverse structural …

Dirac semimetals in two dimensions

SM Young, CL Kane - Physical review letters, 2015 - APS
Graphene is famous for being a host of 2D Dirac fermions. However, spin-orbit coupling
introduces a small gap, so that graphene is formally a quantum spin Hall insulator. Here we …

Synthesis and chemistry of elemental 2D materials

AJ Mannix, B Kiraly, MC Hersam… - Nature Reviews …, 2017 - nature.com
Abstract 2D materials have attracted considerable attention in the past decade for their
superlative physical properties. These materials consist of atomically thin sheets exhibiting …

Phagraphene: a low-energy graphene allotrope composed of 5–6–7 carbon rings with distorted dirac cones

Z Wang, XF Zhou, X Zhang, Q Zhu, H Dong, M Zhao… - Nano …, 2015 - ACS Publications
Using systematic evolutionary structure searching we propose a new carbon allotrope,
phagraphene [fæ'græfi: n], standing for p enta-h exa-hept a-graphene, because the structure …