Search Results - "Vekilova, O. Yu"

Intrinsic magnetic properties of SmFe12−xVx alloys with reduced V-concentration by Schönhöbel, A.M., Madugundo, R., Vekilova, O. Yu, Eriksson, O., Herper, H.C., Barandiarán, J.M., Hadjipanayis, G.C.

“…In this work, we present experimental and theoretical results on SmFe12−xVx (x=0.5−2.0) alloys with the ThMn12 (1:12) structure as possible candidates for rare…”
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Hyperfine splitting and room-temperature ferromagnetism of Ni at multimegabar pressure by Sergueev, I, Dubrovinsky, L, Ekholm, M, Vekilova, O Yu, Chumakov, A I, Zając, M, Potapkin, V, Kantor, I, Bornemann, S, Ebert, H, Simak, S I, Abrikosov, I A, Rüffer, R

“…Magnetic and elastic properties of Ni metal have been studied up to 260 GPa by nuclear forward scattering of synchrotron radiation with the 67.4 keV Mössbauer…”
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Electronic correlations in Fe at Earth's inner core conditions: Effects of alloying with Ni by Vekilova, O. Yu, Pourovskii, L. V., Abrikosov, I. A., Simak, S. I.

“…We have studied the body-centered cubic (bcc), face-centered cubic (fcc), and hexagonal close-packed (hcp) phases of Fe alloyed with 25 at.% of Ni at Earth's…”
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Hyperfine Splitting and Room-Temperature Ferromagnetism of Ni at Multimegabar Pressure by Sergueev, I., Dubrovinsky, L., Ekholm, M., Vekilova, O. Yu, Chumakov, A. I., Zając, M., Potapkin, V., Kantor, I., Bornemann, S., Ebert, H., Simak, S. I., Abrikosov, I. A., Rüffer, R.

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Influence of Ni on the lattice stability of Fe-Ni alloys at multimegabar pressures by Vekilova, O. Yu, Simak, S. I., Ponomareva, A. V., Abrikosov, I. A.

“…The lattice stability trends of the primary candidate for Earth's core material, the Fe-Ni alloy, were examined from first principles. We employed the exact…”
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Intrinsic magnetic properties of SmFe12−V alloys with reduced V-concentration by Schönhöbel, A. M., Madugundo, R., Vekilova, O. Yu, Eriksson, O., Herper, H. C., Barandiarán, J. M., Hadjipanayis, G. C.

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Database of novel magnetic materials for high-performance permanent magnet development by Nieves, P., Arapan, S., Maudes-Raedo, J., Marticorena-Sánchez, R., Del Brío, N.L., Kovacs, A., Echevarria-Bonet, C., Salazar, D., Weischenberg, J., Zhang, H., Vekilova, O.Yu, Serrano-López, R., Barandiaran, J.M., Skokov, K., Gutfleisch, O., Eriksson, O., Herper, H.C., Schrefl, T., Cuesta-López, S.

“…[Display omitted] •Novel theoretical Fe-based binaries predicted by an Adaptive Genetic Algorithm.•Computational high-throughput screening of…”
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Database of novel magnetic materials for high-performance permanent magnet development by Nieves, P, Arapan, S, Maudes, J, Marticorena, R, Del Brío, N. L, Kovacs, A, Echevarria-Bonet, C, Salazar, D, Weischenberg, J, Zhang, H, Vekilova, O. Yu, Serrano-López, R, Barandiaran, J. M, Skokov, K, Gutfleisch, O, Eriksson, O, Herper, H. C, Schrefl, T, Cuesta-López, S

“…Comp.Mater.Sci. 168 (2019) 188-202 This paper describes the open Novamag database that has been developed for the design of novel Rare-Earth free/lean…”
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Intrinsic magnetic properties of SmFe12−V alloys with reduced V-concentration by Schönhöbel, A.M., Madugundo, R., Vekilova, O. Yu, Eriksson, O., Herper, H.C., Barandiarán, J.M., Hadjipanayis, G.C.

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First-principles study of vacancy-hydrogen interaction in Pd by Vekilova, O. Yu, Bazhanov, D. I., Simak, S. I., Abrikosov, I. A.

“…Hydrogen absorption in face-centered-cubic palladium is studied from first principles, with particular focus on interaction between hydrogen atoms and…”
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Electronic correlations in Fe at Earth's inner core conditions: effect of doping with Ni by Vekilova, O. Yu, Pourovskii, L. V, Abrikosov, I. A, Simak, S. I

“…Phys. Rev. B 91, 245116 (2015) We have studied the body-centered cubic (bcc), face-centered cubic (fcc) and hexagonal close-packed (hcp) phases of Fe alloyed…”
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Effect of pressure on phase stability in Fe-Cr alloys by Ponomareva, A. V., Ruban, A. V., Vekilova, O.Yu, Simak, S. I., Abrikosov, I. A.

“…The effect of hydrostatic pressure on the phase stability of Fe-Cr alloys has been studied using ab initio methods. We show that while pressure decreases the…”
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Computational Design of the Rare-Earth Reduced Permanent Magnets by Kovacs, A, Fischbacher, J, Gusenbauer, M, Oezelt, H, Herper, H. C, Vekilova, O. Yu, Nieves, P, Arapan, S, Schrefl, T

“…Multiscale simulation is a key research tool for the quest for new permanent magnets. Starting with first principles methods, a sequence of simulation methods…”
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