Irina V Lebedeva

7PUBLICATIONS
9CO-AUTHORS
Metal organic frameworksRadiation and matterCatalysis and mechanisms of reactionsFormal methods for softwareChemical and thermal processes in energy and combustion
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Publications (7)

|Feb 23, 2024
Optical properties and exciton transfer between N-heterocyclic carbene iridium(III) complexes for blue light-emitting diode applications from first principles.

Irina V Lebedeva, Joaquim Jornet-Somoza

|Oct 04, 2023
Formation of carbon propeller-like molecules from starphenes under electron irradiation.

Nikita A Matsokin, Alexander S Sinitsa, Yulia G Polynskaya

|Jul 25, 2023
Precise graphene cutting using a catalyst at a probe tip under an electron beam.

Alexander S Sinitsa, Yulia G Polynskaya, Irina V Lebedeva

|May 01, 2023
Modular implementation of the linear- and cubic-scaling orbital minimization methods in electronic structure codes using atomic orbitals.

Irina V Lebedeva, Alberto García, Emilio Artacho

|Oct 31, 2022
Reconstruction of Zigzag Graphene Edges: Energetics, Kinetics, and Residual Defects.

Yulia G Polynskaya, Irina V Lebedeva, Andrey A Knizhnik

|May 16, 2019
Real-Time Propagation TDDFT and Density Analysis for Exciton Coupling Calculations in Large Systems.

Joaquim Jornet-Somoza, Irina Lebedeva

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Frequent Collaborators

4 joint publications

Andrey M Popov

2 joint publications

Joaquim Jornet-Somoza

2 joint publications

Alexander S Sinitsa

2 joint publications

Yulia G Polynskaya