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Egor Trushin
Egor Trushin
FAU Erlangen-Nuremberg
Verified email at fau.de
Title
Cited by
Cited by
Year
Understanding band gaps of solids in generalized Kohn–Sham theory
JP Perdew, W Yang, K Burke, Z Yang, EKU Gross, M Scheffler, ...
Proceedings of the national academy of sciences 114 (11), 2801-2806, 2017
5002017
The Nature of One‐Dimensional Carbon: Polyynic versus Cumulenic
C Neiss, E Trushin, A Görling
ChemPhysChem 15, 2497–2502, 2014
762014
Toward chemical accuracy at low computational cost: Density-functional theory with σ-functionals for the correlation energy
E Trushin, A Thierbach, A Görling
The Journal of Chemical Physics 154 (1), 2021
242021
Spin-current density-functional theory for a correct treatment of spin-orbit interactions and its application to topological phase transitions
E Trushin, A Görling
Physical Review B 98 (20), 205137, 2018
242018
Structure and stability of small zinc oxide clusters
EV Trushin, IL Zilberberg, AV Bulgakov
Physics of the Solid State 54, 859-865, 2012
232012
Band gaps, ionization potentials, and electron affinities of periodic electron systems via the adiabatic-connection fluctuation-dissipation theorem
E Trushin, M Betzinger, S Blügel, A Görling
Physical Review B 94 (7), 075123, 2016
172016
Chemical accuracy with σ-functionals for the Kohn–Sham correlation energy optimized for different input orbitals and eigenvalues
S Fauser, E Trushin, C Neiss, A Görling
The Journal of Chemical Physics 155 (13), 2021
162021
Anion-radical oxygen centers in small (AgO)(n) clusters: Density functional theory predictions
EV Trushin, IL Zilberberg
Chemical Physics Letters 560, 37-41, 2013
142013
Scaled σ-functionals for the Kohn–Sham correlation energy with scaling functions from the homogeneous electron gas
J Erhard, S Fauser, E Trushin, A Görling
The Journal of Chemical Physics 157 (11), 2022
112022
Numerically stable optimized effective potential method with standard Gaussian basis sets
E Trushin, A Görling
The Journal of Chemical Physics 155 (5), 2021
92021
First-Principles Calculation of Triplet Exciton Diffusion in Crystalline Poly(p-phenylene vinylene)
I Lyskov, E Trushin, BQ Baragiola, TW Schmidt, JH Cole, SP Russo
The Journal of Physical Chemistry C 123 (44), 26831-26841, 2019
82019
Assessment of the exact-exchange-only Kohn-Sham method for the calculation of band structures for transition metal oxide and metal halide perovskites
E Trushin, L Fromm, A Görling
Physical Review B 100 (7), 075205, 2019
52019
Interpretation of X-ray photoelectron spectra of free nitroxyl radicals
LN Mazalov, AD Fedorenko, VI Ovcharenko, EV Tret’yakov, EY Fursova, ...
Journal of Structural Chemistry 54, 898-906, 2013
5*2013
Assessment of quality and reliability of band structures from exact-exchange-only Kohn–Sham, hybrid, and GW methods
E Trushin, A Görling
The European Physical Journal B 91, 1-7, 2018
22018
Topological Phase Transitions in Zinc-Blende Semimetals Driven Exclusively by Electronic Temperature
E Trushin, A Görling
Physical Review Letters 120 (14), 146401, 2018
22018
Numerically stable inversion approach to construct Kohn–Sham potentials for given electron densities within a Gaussian basis set framework
J Erhard, E Trushin, A Görling
The Journal of Chemical Physics 156 (20), 2022
12022
Lieb–Oxford bound and pair correlation functions for density-functional methods based on the adiabatic-connection fluctuation-dissipation theorem
J Erhard, S Fauser, S Kalaß, E Moerman, E Trushin, A Görling
Faraday Discussions 224, 79-97, 2020
12020
Basis Set Requirements of σ-Functionals for Gaussian-and Slater-Type Basis Functions and Comparison with Range-Separated Hybrid and Double Hybrid Functionals
S Fauser, A Förster, L Redeker, C Neiss, J Erhard, E Trushin, ...
Journal of Chemical Theory and Computation, 2024
2024
Avoiding spin contamination and spatial symmetry breaking by exact-exchange-only optimized-effective-potential methods within the symmetrized Kohn–Sham framework
E Trushin, A Görling
The Journal of Chemical Physics 159 (24), 2023
2023
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Articles 1–19