Irina V Lebedeva (Irina Lebedeva)

ResearcherID ORCID

Publication Activity (10 Years)

Years Active: 2017-2023
Publications (10 Years): 8

Top Topics

Electron Transfer

Molecular Dynamics Simulations

Top Venues

Physical chemistry chemical physics : PCCP

Royal Society open science

The journal of physical chemistry letters

This page only lists publications with an associated author ORCID identifier.

Publications

Irina V Lebedeva, Alberto García, Emilio Artacho, Pablo Ordejón
Modular implementation of the linear- and cubic-scaling orbital minimization methods in electronic structure codes using atomic orbitals. Royal Society open science 10 (4) (2023)
Irina V Lebedeva, Alberto García, Emilio Artacho, Pablo Ordejón
Modular implementation of the linear- and cubic-scaling orbital minimization methods in electronic structure codes using atomic orbitals. Royal Society open science 10 (4) (2023)
Nikita A Matsokin, Alexander S Sinitsa, Yulia G Polynskaya, Irina V Lebedeva, Andrey A Knizhnik, Andrey M Popov
Formation of carbon propeller-like molecules from starphenes under electron irradiation. Physical chemistry chemical physics : PCCP (2023)
Alexander S Sinitsa, Yulia G Polynskaya, Irina V Lebedeva, Andrey A Knizhnik, Andrey M Popov
Precise graphene cutting using a catalyst at a probe tip under an electron beam. Physical chemistry chemical physics : PCCP (2023)
Yulia G Polynskaya, Irina V Lebedeva, Andrey A Knizhnik, Andrey M Popov
Reconstruction of Zigzag Graphene Edges: Energetics, Kinetics, and Residual Defects. The journal of physical chemistry letters 13 (44) (2022)
Micael J T Oliveira, Nick Rübner Papior, Yann Pouillon, Volker Blum, Emilio Artacho, Damien Caliste, Fabiano Corsetti, Stefano De Gironcoli, Alin M Elena, Alberto García, Víctor Manuel García-Suárez, Luigi Genovese, William P Huhn, Georg Huhs, Sebastian Kokott, Emine Küçükbenli, Ask Hjorth Larsen, Alfio Lazzaro, Irina V Lebedeva, Yingzhou Li, David López-Durán, Pablo López-Tarifa, Martin Lüders, Miguel A L Marques, Jan Minar, Stephan Mohr, Arash A Mostofi, Alan O'Cais, Mike C Payne, Thomas Ruh, Daniel G A Smith, José M Soler, David A Strubbe, Nicolas Tancogne-Dejean, Dominic Tildesley, Marc Torrent, Victor Wen-Zhe Yu
The CECAM electronic structure library and the modular software development paradigm. The Journal of chemical physics 153 (2) (2020)
Joaquim Jornet-Somoza, Irina V Lebedeva
Real-Time Propagation TDDFT and Density Analysis for Exciton Coupling Calculations in Large Systems. Journal of chemical theory and computation 15 (6) (2019)
Alexander S Sinitsa, Thomas W Chamberlain, Thilo Zoberbier, Irina V Lebedeva, Andrey M Popov, Andrey A Knizhnik, Robert L McSweeney, Johannes Biskupek, Ute Kaiser, Andrei N Khlobystov
Formation of Nickel Clusters Wrapped in Carbon Cages: Toward New Endohedral Metallofullerene Synthesis. Nano letters 17 (2) (2017)