New structural modifications of diamond: LA9, LA10, and CA12

New polymorphic types of diamond

(2014) E. A. Belenkov et al.   JOURNAL OF STRUCTURAL CHEMISTRY

From Kelvin problem to Kelvin carbons

(2013) Hui-Yan Zhao et al.   JOURNAL OF CHEMICAL PHYSICS

Theoretical prediction of new carbon allotropes

(2013) L. Yang et al.   JOURNAL OF CHEMICAL PHYSICS

A novel superhard BN allotrope under cold compression of h-BN

(2013) Xue Jiang et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Orthorhombic C32: a novel superhard sp3 carbon allotrope

(2013) Miao Zhang et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Carbon structures and defect planes in diamond at high pressure

(2013) Silvana Botti et al.   PHYSICAL REVIEW B

Classification of structural modifications of carbon

(2013) E. A. Belenkov et al.   PHYSICS OF THE SOLID STATE

Hybrid porous nanotube crystal networks for nanostructured device applications

(2012) Alex V. Pokropivny et al.   JOURNAL OF MATERIALS SCIENCE

Metastable C-centered orthorhombic Si8and Ge8

(2012) Jinhui Zhai et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Superhard F-carbon predicted byab initioparticle-swarm optimization methodology

(2012) Fei Tian et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Tetragonal Allotrope of Group 14 Elements

(2012) Zhisheng Zhao et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Semiconducting allotrope of graphene

(2012) Jawad Nisar et al.   NANOTECHNOLOGY

‘C8 phase’: Supercubane, tetrahedral, BC-8 or carbon sodalite?

(2012) Alex Pokropivny et al.   PHYSICA STATUS SOLIDI B-BASIC SOLID STATE PHYSICS

Lowest enthalpy polymorph of cold-compressed graphite phase

(2012) Da Li et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Orthorhombic carbon allotrope of compressed graphite:Ab initiocalculations

(2012) Jian-Tao Wang et al.   PHYSICAL REVIEW B

Families of Superhard Crystalline Carbon Allotropes Constructed via Cold Compression of Graphite and Nanotubes

(2012) Haiyang Niu et al.   PHYSICAL REVIEW LETTERS

Classification and structure of silicon carbide phases

(2012) E. A. Belenkov et al.   PHYSICS OF THE SOLID STATE

New superhard carbon phases between graphite and diamond

(2012) Chaoyu He et al.   SOLID STATE COMMUNICATIONS

Strength and bonding nature of superhard Z-carbon from first-principle study

(2012) Jiaqian Qin et al.   AIP Advances

Structures of diamond-like phases

(2011) V. A. Greshnyakov et al.   JOURNAL OF EXPERIMENTAL AND THEORETICAL PHYSICS

Graphene allotropes

(2011) Andrey N. Enyashin et al.   PHYSICA STATUS SOLIDI B-BASIC SOLID STATE PHYSICS

Effect of pentagons insp3systems on electronic, elastic, and vibrational properties: Case of chiral structures

(2011) Damien Connétable   PHYSICAL REVIEW B

Denser than diamond:Ab initiosearch for superdense carbon allotropes

(2011) Qiang Zhu et al.   PHYSICAL REVIEW B

Amorphous Diamond: A High-Pressure Superhard Carbon Allotrope

(2011) Yu Lin et al.   PHYSICAL REVIEW LETTERS

Superhard and superconducting structures of BC5

(2010) Quan Li et al.   JOURNAL OF APPLIED PHYSICS

Hypothetical low-energy chiral framework structure of group 14 elements

(2010) Chris J. Pickard et al.   PHYSICAL REVIEW B

QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials

(2009) Paolo Giannozzi et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Bubbles and microporous frameworks of silicon carbide

(2009) M. B. Watkins et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS