4) Влияние Ni И Al на кинетику распада и стабильность обогащенных Cu выделений в сплаве Fe–CU–Ni–Al. Результаты MD + MC-моделирования [Текст] / Карькин И.Н., Карькина Л.Е., Горностырев Ю.Н., Коржавый П.А. // Физика металлов и металловедение. — 2021. — V. 122. — P. 535 (6 pages)
5) Effect of Ni and Al on the Decomposition Kinetics and Stability of Cu-Enriched Precipitates in Fe–Cu–Ni–Al Alloys: Results of MD + MC Simulation [Текст] / I. N. Karkin, L. E. Karkina, Yu. N. Gornostyrev, P. A. Korzhavyi // Physics of Metals and Metallography. — 2021. — V. 122. — P. 498 (6 pages)
6) Segregation of alloying elements to stabilize θ′ phase interfaces in Al-Cu based alloys [Текст] / M.V.Petrik, Yu.N.Gornostyrev, P.A.Korzhavyi // Scripta Materialia. — 2021. — V. 202. — P. 114006 (4 pages)
7) The H2S dimer revisited – Insights from wave-function and density functional theory methods. Ab initio molecular dynamics simulations of liquid H2S [Текст] / Cláudio M.Lousada, Pavel A.Korzhavyi // Computational and Theoretical Chemistry. — 2020. — V. 1180. — P. 112821 (8 pages)
8) Investigation on elastic and thermodynamic properties of Fe25Cr20NiMnNb austenitic stainless steel at high temperatures from first principles [Текст] / Jing Zhang, Pavel A.Korzhavyi, Junjing He // Computational Materials Science. — 2020. — V. 185. — P. 109973 (14 pages)
9) First Principles Investigation on Thermodynamic Properties and Stacking Fault Energy of Paramagnetic Nickel at High Temperatures [Текст] / Zhang J., Korzhavyi P.A. // Metals. — 2020. — V. 10. — P. 319 (18 pages)
10) Effective cluster interactions and pre–precipitate morphology in binary Al-based alloys [Текст] / O. I. Gorbatov, A. Yu. Stroev, Yu. N. Gornostyrev, P. A. Korzhavyi // Acta Materialia. — 2019. — V. 179. — P. 70 (15 pages)
11) Kinetics of Early Decomposition Stages in Diluted bcc Fe–Сu–Ni–Al Alloy: MC+MD Simulation [Текст] / Kar’kin I.N., Kar’kina L.E., Gornostyrev Y.N., Korzhavyi A.P. // Physics of the Solid State. — 2019. — V. 61. — P. 601 (8 pages)
12) Atomistic Simulations of Al(100) and Al(111) Surface Oxidation: Chemical and Topological Aspects of the Oxide Structure [Текст] / Marcela E. Trybula, Pavel A. Korzhavyi // Journal of Physical Chemistry C. — 2019. — V. 123. — P. 334 (13 pages)
13) Point defect interactions with Guinier-Preston zones in Al-Cu based
alloys: Vacancy mediated GPZ to θ′-phase transformation [Текст] / M.V. Petrik, Y.N. Gornostyrev, P.A. Korzhavyi // Scripta Materialia. — 2019. — V. 165. — P. 123 (5 pages)
14) Кинетика ранних стадий распада в разбавленном ОЦК-сплаве Fe-Сu-Ni-Al: MC + MD-моделирование [Текст] / Карькин И.Н., Карькина Л.Е., Горностырев Ю.Н., Коржавый А.П. // Физика твёрдого тела. — 2019. — V. 61. — P. 724 (9 pages)
15) Solid solution decomposition and Guinier-Preston zone formation in Al-Cu alloys: A kinetic theory with anisotropic interactions [Текст] / A. Yu. Stroev, O. I. Gorbatov, Yu. N. Gornostyrev, P. A. Korzhavyi // Physical Review Materials. — 2018. — V. 2. — P. 33603 (8 pages)
16) End-member compounds of a 4-sublattice model of multicomponent BCC solid solutions [Текст] / Delandar A.H., Gorbatov O.I., Selleby M., Gornostyrev Y.N., Korzhavyi P.A. // Data in Brief. — 2018. — V. 20. — P. 1018 (5 pages)
17) The first stages of oxide growth at the low index Al surfaces (100), (110), (111): clusters and stripes vs. homogeneous growth [Текст] / Cla´udio M. Lousada, Pavel A. Korzhavyiab // PHYSICAL CHEMISTRY CHEMICAL PHYSICS. — 2018. — V. 20. — P. 29549 (9 pages)
18) Ab-initio based search for late blooming phase compositions in iron alloys [Текст] / A.H. Delandar, O.I. Gorbatov, M. Selleby, Yu. N. Gornostyrev, P. A. Korzhavyi // Journal of Nuclear Materials. — 2018. — V. 509. — P. 225 (11 pages)
19) Molecular and dissociative adsorption of water at a defective Cu(110) surface [Текст] / Lousada C.M., Johansson A.J., Korzhavyi P.A. // Surface Science. — 2017. — V. 658. — P. 1 (8 pages)
20) Monte Carlo Simulation of the Kinetics of Decomposition and the Formation of Precipitates at Grain Boundaries
of the General Type in Dilute BCC Fe–Cu Alloys [Текст] / I. N. Kar’kina, L. E. Kar’kina, P. A. Korzhavyi, Yu. N. Gornostyrev // Physics of the Solid State. — 2017. — V. 59. — P. 106 (8 pages)
21) Many-body interactions in the Al–Cu system [Текст] / O.I. Gorbatov, Yu. N. Gornostyrev, P.A. Korzhavyi // Data in Brief. — 2017. — V. 15. — P. 770 (5 pages)
22) Many-body mechanism of Guinier-Preston zones stabilization in Al-Cu alloys [Текст] / Gorbatov O. I., Gornostyrev Yu. N., Korzhavyi P. A. // Scripta Materialia. — 2017. — V. 138. — P. 130 (4 pages)
23) The role of group III, IV elements in Nb(4)AC(3) MAX phases (A = Al, Si, Ga, Ge) and the unusual anisotropic behavior of the electronic and optical properties [Текст] / Fu Yu-dong, Wang Baochang, Teng Yue, Zhu Xiao-shuo, Feng Xiao-xue, Yan Mu-fu, Korzhavyi Pavel, Sun Weiwei // PHYSICAL CHEMISTRY CHEMICAL PHYSICS. — 2017. — V. 19. — P. 15471 (13 pages)
24) Моделирование методом Монте-Карло кинетики распада и образования выделений на границах зерен общего типа в разбавленных ОЦК-сплавах Fe-Сu
[Текст] / Карькин И.Н., Карькина Л.Е., Коржавый П.А., Горностырев Ю.Н. // Физика твёрдого тела. — 2017. — V. 59. — P. 103 (8 pages)
25) A new 2D monolayer BiXene, M2C (M = Mo, Tc, Os) [Текст] / Weiwei Sun, Yunguo Li, Baotian Wang, Xue Jiang, Mikhail I. Katsnelson, Pavel Korzhavyi, Olle Eriksson, Igor Di Marco // Nanoscale. — 2016. — V. 8. — P. 15753 (7 pages)
26) Solute-grain boundary interaction and segregation formation in Al: First principles calculations and molecular dynamics modeling [Текст] / Karkina L. E., Karkin I. N., Kuznetsov A. R., Razumov I. K., Korzhavyi P. A., Gornostyrev Yu. N. // Computational Materials Science. — 2016. — V. 112. — P. 18 (9 pages)
27) First-principles study of interactions between substitutional solutes in bcc iron [Текст] / Gorbatov O.I., Delandar A.H., Gornostyrev Y.N., Ruban A.V., Korzhavyi P.A. // Journal of Nuclear Materials. — 2016. — V. 475. — P. 140 (9 pages)
28) Кинетика распада в разбавленных сплавах Fe-Cu. Монте-Карло моделирование с ab-initio концентрационно-зависимыми взаимодействиями [Текст] / И.Г.Шмаков, И.К.Разумов, О.И.Горбатов, Ю.Н.Горностырев, П.А.Коржавый // Письма в ЖЭТФ. — 2016. — V. 103. — P. 119 (5 pages)
29) Decomposition Kinetics in Fe–Cu Dilute Alloys. Monte Carlo Simulation Using Concentration-Dependent Interactions. [Текст] / I.G.Shmakov, I.K.Razumov, O.I.Gorbatov, Yu.N.Gornostyrev, P.A.Korzhavyi // JETP Letters. — 2016. — V. 103. — P. 112 (5 pages)
30) Ab initio Modeling of Decomposition in Iron Based Alloys [Текст] / O. I. Gorbatov, Yu. N. Gornostyrev, P. A. Korzhavyi, A. V. Ruban // Physics of Metals and Metallography (english only). — 2016. — V. 117. — P. 1293 (35 pages)
31) Structure and energy of point defects in TiC: An ab initio study [Текст] / Sun W., Ehteshami H., Korzhavyi P.A. // Physical Review B. — 2015. — V. 91. — P. 134111 (6 pages)
32) Effect of Ni and Mn on the formation of Cu precipitates in a-Fe [Текст] / O.I. Gorbatov, Yu.N. Gornostyrev, P.A. Korzhavyi, A.V. Ruban // Scripta Materialia. — 2015. — V. 102. — P. 11 (4 pages)
33) SEGREGATION OF Mg TO GENERIC TILT GRAIN BOUNDARIES
IN Al: MONTE CARLO MODELING [Текст] / I.N. Karkin, L.E. Karkina, A.R. Kuznetsov, M.V. Petrik, Yu.N. Gornostyrev, P.A. Korzhavyi // Materials Physics and mechanics. — 2015. — V. 24. — P. 201 (10 pages)
34) Interactions of point defects with stacking faults in oxygen-free phosphorus-containing copper [Текст] / Li Y., Korzhavyi P.A. // Journal of Nuclear Materials. — 2015. — V. 462. — P. 160 (5 pages)
35) Effect of magnetism on the solubility of 3d elements in BCC iron: Results of first-principle investigations
[Текст] / O. I. Gorbatov, S. V. Okatov, Yu. N. Gornostyrev, P. A. Korzhavyi, A. V. Ruban // Physics of Metals and Metallography. — 2013. — V. 114. — P. 642 (12 pages)
36) Влияние магнетизма на растворимость 3d элементов в ОЦК Fe. Результаты первопринципных исследований [Текст] / О. И. Горбатов, С. В. Окатов, Ю. Н. Горностырев, П. А. Коржавый, А. В. Рубан // Физика металлов и металловедение. — 2013. — V. 114. — P. 698 (13 pages)
37) Role of magnetism in Cu precipitation in alpha-Fe [Текст] / O. I. Gorbatov, I. K. Razumov, Yu. N. Gornostyrev, V. I. Razumovskiy, P. A. Korzhavyi, A. V. Ruban // Physical Review B. — 2013. — V. 88. — P. 174113 (1 pages)
38) Vacancy–solute interactions in ferromagnetic and paramagnetic bcc iron: Ab initio calculations [Текст] / O.I. Gorbatov, P.A. Korzhavyi, A.V. Ruban, B. Johansson, Yu.N. Gornostyrev // Journal of Nuclear Materials. — 2011. — V. 419. — P. 248 (8 pages)
39) Dependence of vacancy-solute interactions on magnetic state in dilute iron-based alloys [Текст] / O.I. Gorbatov, A.V. Ruban, P. A. Korzhavyi, Yu. N. Gornostyrev // Sol. Stat. Phenomena. — 2011. — V. 172-174. — P. 979 (6 pages)
40) Электронная структура и магнитные свойства сплавов RNi(5-x)Cu(x) (R= Y, La, Ce). [Текст] / Г. Е. Гречнев, А. В. Логоша, И. В. Свечкарев, А. Г. Кучин, Ю. А. Куликов, P. A. Korzhavyi, O. Eriksson. // Физика низких температур. — 2006. — V. 32. — P. 1498 (9 pages)
41) Electronic structure and magnetic properties of RNi5−xCux alloys (R=Y, La, Ce) [Текст] / G. E. Grechnev, A. V. Logosha, I. V. Svechkarev, A. G. Kuchin, Yu. A. Kulikov, P. A. Korzhavyi, O. Eriksson // Low temperature physics. — 2006. — V. 32. — P. 1140 (7 pages)