Zobrazeno 1 - 10
of 36
pro vyhledávání: '"H R Chauke"'
Publikováno v:
MRS Advances.
Magnetic functional materials remain an area of research interest for applications in electronic devices. Among these materials, Mn50Pt50 alloy has received a great deal of attention in practical potential applications such as spintronics due to its
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::6c718557200967133531e706c3c39cfc
https://doi.org/10.1557/s43580-023-00568-4
https://doi.org/10.1557/s43580-023-00568-4
Autor:
H. R. Chauke, Charles Richard Catlow, Scott M. Woodley, Phuti E. Ngoepe, Tshegofatso M. Phaahla, Alexey A. Sokol
Publikováno v:
South African Journal of Chemistry; Vol. 74 (2021); 17–22
Molecular dynamics simulations were performed to investigate the stability with respect to increasing the simulated temperature from 300 to 2400 K of an isolated cluster composed of 32 titanium atoms. The interatomic interactions were modelled using
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::ef42faf973248e9d7855103ad0284be8
https://www.ajol.info/index.php/sajc/article/view/240973
https://www.ajol.info/index.php/sajc/article/view/240973
Publikováno v:
Journal of Materials Research. 36:592-601
Adsorption of halogen on the metal surface has received much attention due to its technological applications and major relevance for material surface processing, corrosion protection and etching. In this work, first-principle approach was used to inv
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::9afea51552405ed2a3055d161b206aa7
https://doi.org/10.1557/s43578-021-00106-8
https://doi.org/10.1557/s43578-021-00106-8
Publikováno v:
Materials Today: Proceedings. 38:1071-1076
TiPd alloys have been suggested for commercial applications due to their high strength and good corrosion resistance. An improvement upon its stability through alloying with Ru requires an understanding of its thermodynamics, which currently is not c
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::6c04ad29a975f81c05f49fa282665a54
https://doi.org/10.1016/j.matpr.2020.05.806
https://doi.org/10.1016/j.matpr.2020.05.806
Publikováno v:
MRS Advances. 5:1185-1193
Iron aluminide intermetallic alloys are of great importance in many industries due to their excellent oxidation resistance, low cost, low density, resistance to corrosion and good ductility at room temperature. However, these alloys suffer limited ro
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::8d15bb768d04a0e183c86e62cde3b961
https://doi.org/10.1557/adv.2020.177
https://doi.org/10.1557/adv.2020.177
Publikováno v:
MRS Advances. 4:2419-2429
The stability of the Ti50Pd50-xRux alloy was investigated using first-principles density functional theory within the plane-wave pseudopotential method. Firstly, the Ti50Pd50 gave equilibrium lattice parameter and lowest heats of formation in better
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::25c1f10717c4d3e09e3dd8d77507ec0b
https://doi.org/10.1557/adv.2019.331
https://doi.org/10.1557/adv.2019.331
Publikováno v:
Computational and Theoretical Chemistry. 1155:67-74
Olivine LiFePO4 is a promising cathode material for lithium ion batteries. Its delithiated form FePO4 has attracted interest as potential cathode for rechargeable lithium ion batteries due to high charge/discharge capacity and low cost. This paper re
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::e9244a462eb640d520e336e2b5f74500
https://doi.org/10.1016/j.comptc.2019.03.009
https://doi.org/10.1016/j.comptc.2019.03.009
Publikováno v:
Bulletin of Materials Science. 43
Ab-initio density functional theory calculations have been used to explore the effect of transition metal alloying on A15 Cr–Ru intermetallic alloys. We study the structural, electronic and mechanical properties of $$\hbox {Ru}_{{\mathrm {3}}}\hbox
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::36c5c03a926b1414ae16fbe9c23ce51d
https://doi.org/10.1007/s12034-020-02084-9
https://doi.org/10.1007/s12034-020-02084-9
Publikováno v:
MRS Advances. 3:2151-2158
Zirconium has attracted a lot of attention recently due to its distinctive properties that make it suitable for extensive applications in the nuclear power and chemical industry. Zirconium and its alloys are undergoing long-term development as promis
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::af53949fd4dc432c9add1e360f18103c
https://doi.org/10.1557/adv.2018.500
https://doi.org/10.1557/adv.2018.500
Publikováno v:
Key Engineering Materials. 770:230-238
In this study, we investigate the effect of ternary addition on the structural, mechanical properties and temperature dependence of Ti-based as potential shape memory alloys using molecular dynamics approach. We found that binary Ti-Pt alloys exhibit
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::fddabd51bb408a6b2259b82730773ab7
https://doi.org/10.4028/www.scientific.net/kem.770.230
https://doi.org/10.4028/www.scientific.net/kem.770.230