Artem Oganov

Head of MIPT’s Computational Materials Discovery Laboratory, Skoltech professor, a fellow of the Royal Society of Chemistry, U.K., for outstanding contribution to the development of chemistry.

Education
ScD in physics and mathematics
Professional experience
Professor
Academic Interests
Publications

2016, SCIENTIFIC REPORTS (5.578)

Superconductivity of novel tin hydrides (SnnHm) under pressure

2016, RSC ADVANCES (3.84)

Explaining stability of transition metal carbides - and why TcC does not exist

2015, JOURNAL OF COMPUTATIONAL CHEMISTRY (3.601)

d-AO Spherical Aromaticity in Ce6O8

2015, SCIENTIFIC REPORTS (5.078)

Prediction of novel stable compounds in the Mg-Si-O system under exoplanet pressures

2015, SCIENCE (31.477)

Synthesis of borophenes: Anisotropic, two-dimensional boron polymorphs

2015, SCIENTIFIC REPORTS (5.078)

Pressure-driven formation and stabilization of superconductive chromium hydrides

2015, SCIENTIFIC REPORTS (5.078)

Rational design of inorganic dielectric materials with expected permittivity

2015, SCIENTIFIC REPORTS (5.078)

Nitrogen oxides under pressure: Stability, ionization, polymerization, and superconductivity

2015, PHYSICAL REVIEW B (3.664)

Pressure-induced novel compounds in the Hf-O system from first-principles calculations

2015, SCIENTIFIC REPORTS (5.078)

Novel lithium-nitrogen compounds at ambient and high pressures

2015, NANO LETTERS (12.94)

Phagraphene: A Low-Energy Graphene Allotrope Composed of 5-6-7 Carbon Rings with Distorted Dirac Cones

2015, SCIENTIFIC REPORTS (5.078)

Stable magnesium peroxide at high pressure

2015, PHYSICAL REVIEW B (3.664)

Effects of ferroelectric polarization on surface phase diagram: Evolutionary algorithm study of the BaTiO3(001) surface

2015, PHYSICAL REVIEW B (3.664)

Generalized evolutionary metadynamics for sampling the energy landscapes and its applications

2015, JOURNAL OF CHEMICAL PHYSICS (3.122)

Backbone NxH compounds at high pressures

2015, SCIENTIFIC REPORTS (5.078)

Formation of As-As Interlayer Bonding in the collapsed tetragonal phase of NaFe2As2 under pressure

2015, SCIENTIFIC REPORTS (5.078)

The phase diagram and hardness of carbon nitrides

2015, NATURE COMMUNICATIONS (10.742)

Investigation of exotic stable calcium carbides using theory and experiment

2015, SCIENTIFIC REPORTS (5.078)

Prediction of new thermodynamically stable aluminum oxides

2015, SCIENTIFIC REPORTS (5.078)

Formation of Stoichiometric CsFn Compounds

2015, PHYSICAL REVIEW B (3.664)

Prediction of a stable post-post-perovskite structure from first principles

2015, PHYSICAL CHEMISTRY CHEMICAL PHYSICS (4.198)

A novel phase of beryllium fluoride at high pressure

2015, PHYSICAL CHEMISTRY CHEMICAL PHYSICS (4.198)

Phase stability, chemical bonding and mechanical properties of titanium nitrides: A first-principles study

2015, PHYSICAL CHEMISTRY CHEMICAL PHYSICS (4.198)

Novel compounds in the Zr-O system, their crystal structures and mechanical properties

2015, ADVANCED ENERGY MATERIALS (14.385)

A Novel Phase of Li-15-Si-4 Synthesized under Pressure

2014, PHYSICAL REVIEW LETTERS (7.728)

New reconstructions of the (110) surface of rutile TiO2 predicted by an evolutionary method

2014, PHYSICS LETTERS A (1.626)

High throughput exploration of ZrxSi1_O-x(2) dielectrics by evolutionary first-principles approaches

2014, JOURNAL OF CHEMICAL PHYSICS (3.122)

Predicting polymeric crystal structures by evolutionary algorithms

2014, PHYSICAL REVIEW LETTERS (7.728)

Unexpected Reconstruction of the alpha-Boron (111) Surface

2014, AIP ADVANCES (1.59)

Exploration of stable compounds, crystal structures, and superconductivity in the Be-H system

2014, NATURE COMMUNICATIONS (10.742)

Rational design of all organic polymer dielectrics

2014, SCIENTIFIC REPORTS (5.078)

Novel superconducting skutterudite-type phosphorus nitride at high pressure from first-principles calculations

2014, APPLIED PHYSICS LETTERS (3.515)

Discovering low-permittivity materials: Evolutionary search for MgAl2O4 polymorphs

2014, SCIENTIFIC REPORTS (5.078)

Novel Hydrogen Hydrate Structures under Pressure

2014, INORGANIC CHEMISTRY (4.794)

Synthesis of beta-Mg2C3: A Monoclinic High-Pressure Polymorph of Magnesium Sesquicarbide

2014, JOURNAL OF SUPERHARD MATERIALS (0.654)

Metastable host-guest structure of carbon

2014, PHYSICAL REVIEW B (3.664)

Tuning the crystal structure and electronic states of Ag2Se: Structural transitions and metallization under pressure

2014, PHYSICS LETTERS A (1.626)

First-principles calculations of the dielectric and vibrational properties of ferroelectric and paraelectric BaAl2O4

2014, EPL (2.269)

Prediction of the atomic structure and stability for the ensemble of silicon nanoclusters passivated by hydrogen

2014, PHYSICAL REVIEW LETTERS (7.728)

Semimetallic Two-Dimensional Boron Allotrope with Massless Dirac Fermions

2014, ACTA CRYSTALLOGRAPHICA SECTION C-CRYSTAL STRUCTURE COMMUNICATIONS (0.535)

Evolutionary search for new high-k dielectric materials: methodology and applications to hafnia-based oxides

2014, PHYSICAL CHEMISTRY CHEMICAL PHYSICS (4.198)

Variable-composition structural optimization and experimental verification of MnB3 and MnB4

2014, TOPICS IN CURRENT CHEMISTRY (4.607)

Crystal structure prediction and its application in earth and materials sciences

2014, PHYSICAL CHEMISTRY CHEMICAL PHYSICS (4.198)

BaC: a thermodynamically stable layered superconductor

2013, SCIENCE (31.477)

Unexpected Stable Stoichiometries of Sodium Chlorides

2013, PHYSICAL REVIEW B (3.664)

Prediction of stable hafnium carbides: Stoichiometries, mechanical properties, and electronic structure

2013, PHYSICAL REVIEW B (3.664)

Evolutionary method for predicting surface reconstructions with variable stoichiometry

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (4.198)

Alkali subhalides: High-pressure stability and interplay between metallic and ionic bonds

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (4.198)

Novel superhard B-C-O phases predicted from first principles

SPECTROSCOPIC PROPERTIES OF INORGANIC AND ORGANOMETALLIC COMPOUNDS

Structure prediction and its applications in computational materials design

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (11.336)

Antiferromagnetic Stabilization in the Ti8O12 Cluster

Theory of Superhard Materials