Robert Evarestov
机构: St Petersburg State University
每年引用次数
引用次数
引用: 8,639
H-指数: 43
I10-指数 : 176
出版物: 448
Antiferromagnetism-induced spin splitting in monolayers of layered and non-layered crystals: Symmetry-based analysis and Density Functional Theory calculation
Sergei A Egorov , Robert A Evarestov
Physica E: Low-dimensional Systems and Nanostructures 139 115118
3
2022
DFT modeling of electronic and mechanical properties of polytwistane using line symmetry group theory
Anton V Domnin , Vitaly V Porsev , Robert A Evarestov
Computational Materials Science 214 111704
1
2022
Ab initio modeling of helically periodic nanostructures using CRYSTAL17: A general algorithm first applied to nanohelicenes
Vitaly V Porsev , Andrei V Bandura , Robert A Evarestov
Computational Materials Science 203 111063
6
2022
Spin splitting in monoperiodic systems described by magnetic line groups
Sergei A Egorov , Daniel B Litvin , Andrei V Bandura , Robert A Evarestov
Journal of Physics: Condensed Matter 34 ( 31) 315803
2022
Single-wall pristine and Janus nanotubes based on post-transition metal chalcogenides. First-principles study
Andrei V Bandura , Dmitry D Kuruch , Vitaly V Porsev , Robert A Evarestov
Physica E: Low-dimensional Systems and Nanostructures 147 115611
2023
Antiferromagnetism-induced spin splitting in systems described by magnetic layer groups
Sergei A Egorov , Daniel B Litvin , Robert A Evarestov ,
The Journal of Physical Chemistry C 125 ( 29) 16147 -16154
15
2021
Spin splitting in systems described by magnetic rod groups
Sergei A Egorov , Daniel B Litvin , Andrei V Bandura , Robert A Evarestov
The Journal of Physical Chemistry C 126 ( 11) 5362 -5367
4
2022
Hybrid density functional theory calculations on phonons in LaCoO3
Denis Gryaznov , Robert A Evarestov , Joachim Maier
arXiv preprint arXiv:1008.1005
2010
Electronic Supporting Information for the article Near infrared [Ir (N^ C) 2 (N^ N)] emitters and their noncovalent adducts with human serum albumin: synthesis, photophysical and computational study.
Ilya S Kritchenkov , Pavel S Chelushkin , Viktor V Sokolov , Vladimir V Pavlovskiy
Unusual Effects of the Metal Center Coordination Mode on the Photophysical Behavior of the Rhenium (I) and Rhenium (I)–Iridium (III) Complexes
Kristina S Kisel , Julia R Shakirova , Vladimir V Pavlovskiy , Robert A Evarestov
Inorganic Chemistry 62 ( 45) 18625 -18640
2023
Supplemental Material for the paper:“Interpretation of unexpected behavior of infrared absorption spectrum of ScF3 beyond quasiharmonic approximation”
Sergei Piskunov , Pjotrs A Zguns , Dmitry Bocharov , Alexei Kuzmin
NIR emitting platinum pincer complexes based on the N boolean AND N boolean AND C ligand containing {benz [4, 5] imidazo [1, 2-a] pyrazin} aromatic system; synthesis, characterization and photophysical study
Julia R Shakirova , Zohreh Hendi , Daniil D Zhukovsky , Victor V Sokolov
Inorganica Chimica Acta 511
2020
Interpretation of unexpected behavior of infrared absorption spectra of ScF 3 beyond the quasiharmonic approximation
Sergei Piskunov , Pjotrs A Žguns , Dmitry Bocharov , Alexei Kuzmin
Physical Review B 93 ( 21) 214101
16
2016
The site-symmetry induced representations of layer groups on the Bilbao Crystallographic Server
Gemma de la Flor , Danel Orobengoa , Robert A Evarestov , Yuri E Kitaev
J Appl Cryst 52 ( 10) 1214 -1221
9
2019
Site symmetry in crystals: theory and applications
Robert A Evarestov , Vyacheslav P Smirnov
Springer Science & Business Media 108
185
2012
Ab initio modeling of helical polyacetylenes: Peierls and Mott-Hubbard metal–insulator transitions
Vitaly V Porsev , Robert A Evarestov
Computational Materials Science 213 111642 -111642
8
2022
Effect of the armchair and zigzag edge terminations on the properties of nanohelicenes: First-principles study
Anton V Domnin , Vitaly V Porsev , Robert A Evarestov
Computational Condensed Matter 36 e00826 -e00826
7
2023
Nonsymmetric [Pt (C^ N* N′^ C′)] Complexes: Aggregation‐Induced Emission in the Solid State and in Nanoparticles Tuned by Ligand Structure
Anastasia I Solomatina , Ekaterina E Galenko , Daria O Kozina , Alexey A Kalinichev
Chemistry–A European Journal 28 ( 64) e202202207 -e202202207
7
2022
Density functional and force field modeling of multi-walled WS2 nanotubes
Andrei V Bandura , Sergey I Lukyanov , Anton V Domnin , Dmitry D Kuruch
Computational and Theoretical Chemistry 1229 114333 -114333
4
2023
Current State of Computational Modeling of Nanohelicenes
Vitaly V Porsev , Robert A Evarestov
Nanomaterials 13 ( 16) 2295 -2295
2
2023