High-Pressure Synthesis of Dirac Materials: Layered van der Waals Bonded BeN4 Polymorph

High‐Pressure Synthesis of Metal–Inorganic Frameworks Hf 4 N 20 ⋅N 2 , WN 8 ⋅N 2 , and Os 5 N 28 ⋅3 N 2 with Polymeric Nitrogen Linkers

(2020) Maxim Bykov et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Re-examining the crystal structure behaviour of nitrogen and methane

(2020) Helen E. Maynard-Casely et al.   IUCrJ

Dinitrogen as a Universal Electron Acceptor in Solid-State Chemistry: An Example of Uncommon Metallic Compounds Na3(N2)4 and NaN2

(2020) Maxim Bykov et al.   INORGANIC CHEMISTRY

Surface energies, adhesion energies, and exfoliation energies relevant to copper-graphene and copper-graphite systems

(2019) Yong Han et al.   SURFACE SCIENCE

Stable zigzag and tripodal all-nitrogen anion N44− in BeN2

(2019) Jiani Lin et al.   AIP Advances

Synthesis of Arsenopyrite-Type Rhodium Pernitride RhN2 from a Single-Source Azide Precursor

(2019) Maxim Bykov et al.   EUROPEAN JOURNAL OF INORGANIC CHEMISTRY

High-pressure synthesis of ultraincompressible hard rhenium nitride pernitride Re2(N2)(N)2 stable at ambient conditions

(2019) Maxim Bykov et al.   Nature Communications

Penta- and hexa-coordinated beryllium and phosphorus in high-pressure modifications of CaBe2P2O8

(2019) Anna Pakhomova et al.   Nature Communications

Electronic properties and oxygen reduction reaction catalytic activity of h-BeN2 and MgN2 by first-principles calculations

(2019) Yi-min Ding et al.   NANOTECHNOLOGY

Synthesis of magnesium-nitrogen salts of polynitrogen anions

(2019) Dominique Laniel et al.   Nature Communications

High-Pressure Synthesis of a Nitrogen-Rich Inclusion Compound ReN8 ⋅x  N2 with Conjugated Polymeric Nitrogen Chains

(2018) Maxim Bykov et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

A New Anisotropic Dirac Cone Material: A B2S Honeycomb Monolayer

(2018) Yu Zhao et al.   Journal of Physical Chemistry Letters

Fe-N system at high pressure reveals a compound featuring polymeric nitrogen chains

(2018) M. Bykov et al.   Nature Communications

Be3N2 monolayer: A graphene-like two-dimensional material and its derivative nanoribbons

(2018) Changpeng Chen et al.   AIP Advances

Pressure-induced stable BeN 4 as a high-energy density material

(2017) Shoutao Zhang et al.   JOURNAL OF POWER SOURCES

Dirac Fermions in Borophene

(2017) Baojie Feng et al.   PHYSICAL REVIEW LETTERS

Lorentz-violating type-II Dirac fermions in transition metal dichalcogenide PtTe2

(2017) Mingzhe Yan et al.   Nature Communications

Computer-Assisted Inverse Design of Inorganic Electrides

(2017) Yunwei Zhang et al.   Physical Review X

High-Pressure Synthesis of a Pentazolate Salt

(2016) Brad A. Steele et al.   CHEMISTRY OF MATERIALS

A Survey of Topology-based Methods in Visualization

(2016) C. Heine et al.   COMPUTER GRAPHICS FORUM

High-pressure stability and ambient metastability of marcasite-type rhodium pernitride

(2016) K. Niwa et al.   JOURNAL OF APPLIED PHYSICS

A Honeycomb BeN2 Sheet with a Desirable Direct Band Gap and High Carrier Mobility

(2016) Cunzhi Zhang et al.   Journal of Physical Chemistry Letters

Analysis of Dirac Point in the Organic Conductor α-(BEDT-TTF)2I3

(2016) Yoshikazu Suzumura   JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN

Atomic intercalation to measure adhesion of graphene on graphite

(2016) Jun Wang et al.   Nature Communications

Observation of quasi-two-dimensional Dirac fermions in ZrTe5

(2016) Xiang Yuan et al.   NPG Asia Materials

EosFit7-GUI: a new graphical user interface for equation of state calculations, analyses and teaching

(2016) Javier Gonzalez-Platas et al.   JOURNAL OF APPLIED CRYSTALLOGRAPHY

The thermodynamic scale of inorganic crystalline metastability

(2016) W. Sun et al.   Science Advances

DIOPTAS: a program for reduction of two-dimensional X-ray diffraction data and data exploration

(2015) Clemens Prescher et al.   HIGH PRESSURE RESEARCH

Observation of tunable band gap and anisotropic Dirac semimetal state in black phosphorus

(2015) J. Kim et al.   SCIENCE

First principles phonon calculations in materials science

(2015) Atsushi Togo et al.   SCRIPTA MATERIALIA

Measurement of the cleavage energy of graphite

(2015) Wen Wang et al.   Nature Communications

SHELXT– Integrated space-group and crystal-structure determination

(2015) George M. Sheldrick   Acta Crystallographica A-Foundation and Advances

Equation of state of rhenium and application for ultra high pressure calibration

(2014) Simone Anzellini et al.   JOURNAL OF APPLIED PHYSICS

Fermi Condensation Near van Hove Singularities Within the Hubbard Model on the Triangular Lattice

(2014) Dmitry Yudin et al.   PHYSICAL REVIEW LETTERS

Crystallographic Computing System JANA2006: General features

(2014) Václav Petříček et al.   Zeitschrift fur Kristallographie-Crystalline Materials

Monte Carlo Study of the Semimetal-Insulator Phase Transition in Monolayer Graphene with a Realistic Interelectron Interaction Potential

(2013) M. V. Ulybyshev et al.   PHYSICAL REVIEW LETTERS

Photoinduced Topological Phase Transition and a Single Dirac-Cone State in Silicene

(2013) Motohiko Ezawa   PHYSICAL REVIEW LETTERS

Dual origin of defect magnetism in graphene and its reversible switching by molecular doping

(2013) R.R. Nair et al.   Nature Communications

Electronic crystals: an experimental overview

(2012) Pierre Monceau   ADVANCES IN PHYSICS

Graphene in periodic deformation fields: Dielectric screening and plasmons

(2012) V. K. Dugaev et al.   PHYSICAL REVIEW B

Dirac Semimetal in Three Dimensions

(2012) S. M. Young et al.   PHYSICAL REVIEW LETTERS

Maximally localized Wannier functions: Theory and applications

(2012) Nicola Marzari et al.   REVIEWS OF MODERN PHYSICS

Van der Waals density functionals applied to solids

(2011) Jiří Klimeš et al.   PHYSICAL REVIEW B

Strength of Effective Coulomb Interactions in Graphene and Graphite

(2011) T. O. Wehling et al.   PHYSICAL REVIEW LETTERS

Effects of strain on electronic properties of graphene

(2010) Seon-Myeong Choi et al.   PHYSICAL REVIEW B

Observation of Dirac Cone Electronic Dispersion inBaFe2As2

(2010) P. Richard et al.   PHYSICAL REVIEW LETTERS

OLEX2: a complete structure solution, refinement and analysis program

(2009) Oleg V. Dolomanov et al.   JOURNAL OF APPLIED CRYSTALLOGRAPHY

Chemical accuracy for the van der Waals density functional

(2009) Jiří Klimeš et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Group II element nitrides M3N2under pressure: a comparative density functional study

(2009) S. Rebecca Römer et al.   PHYSICA STATUS SOLIDI B-BASIC SOLID STATE PHYSICS

Anisotropic behaviours of massless Dirac fermions in graphene under periodic potentials

(2008) Cheol-Hwan Park et al.   Nature Physics

wannier90: A tool for obtaining maximally-localised Wannier functions

(2007) Arash A. Mostofi et al.   COMPUTER PHYSICS COMMUNICATIONS