Density Functional Theory Dft News Today : Breaking News, Live Updates & Top Stories | Vimarsana

Stay updated with breaking news from Density functional theory dft . Get real-time updates on events, politics, business, and more. Visit us for reliable news and exclusive interviews.

Top News In Density Functional Theory Dft Today - Breaking & Trending Today

MIT students win national materials design competition

MIT seniors Louise Anderfaas and Darsh Grewal won the 2023 ASM competition with innovative materials design. Their computational design strategy focuses on enhanced strength. ....

Gregory Olson , Margianna Tzini , Louise Anderfaas , Michigan Technological University , Materials Genome Initiative , Northwestern University , Purdue University , Materials Education Foundation , National Laboratory , Department Of Materials Science , Education Foundation , Professor Gregory Olson , Computational Materials Design , Materials Science , Thermo Calc Professor , Mit Materials Science And Engineering , Mit Dmse , It Class 3 041 Computational Materials Design , Asm Materials Education Foundation , Sm Competition , Computational Design , Louise Anderfaas , Harsh Grewal , Uper Strong Aluminum , Gregory Olson , Margianna Tzini ,

"Effect of tungsten doping on the irradiation resistance of FeCrV-based" by Arman Hobhaydar, Xiao Wang et al.

Given the increasing demand for energy and the rising cost of fossil fuels, the development of nuclear fission and fusion reactors has become a key priority. Recently, High Entropy Alloys (HEAs) and Medium Entropy Alloys (MEAs) have emerged as promising materials for use in nuclear reactors due to their unique properties, which include significant lattice distortion, high configurational entropy, reduced diffusivity, and the cocktail effect. In this study, we designed and analysed a series of FeCrV-based Refractory Medium-entropy Alloys (RMEAs) as structural materials in fusion reactors, using Density Functional Theory. By calculating the empirical parameters, we have verified the solid solution's structure stability of the FeCrV-based RMEA. We examined the mechanical, electronic, and irradiation resistance properties of these alloys and found that the incorporation of tungsten dopants could enhance both the mechanical properties and irradiation resistance of the materials, with t ....

High Entropy Alloys , Medium Entropy Alloys , Fecrv Based Refractory Medium Entropy Alloys , Density Functional , Density Functional Theory Dft , Igh Entropy Alloys Hea , Rradiation Resistance , Edium Entropy Alloy Mea , Nuclear Materials ,

"Physicochemical investigation of the enhanced removal of methylene blu" by Kunlanat Sriphumrat, Yutthana Wongnongwa et al.

Polydopamine/Ag (PDA/Ag) nanoparticles were synthesized for methylene blue (MB) removal from aqueous solution as a model dye. These particles were prepared in a modified literature procedure in which polydopamine (PDA) nanoparticles were first prepared via the oxidative polymerization of dopamine (DA) under alkaline conditions in the presence of oxygen. Subsequently, nanoparticulate PDA/Ag was accessed from direct reduction of silver precursor [Ag(NH3)2]+ ions by catechol amino groups in the PDA structure to form Ag nanoparticles (AgNPs) fixed on the PDA surface. Confirmation of the formation of the PDA and PDA/Ag nanoparticles, plus characterization of their surface morphologies was achieved. In the MB adsorption studies, the various factors affecting the dye adsorption and thermodynamic parameters were investigated in detail. This adsorption process can be described well by the Langmuir model. In order to gain a deeper molecular insight into this process, we investigated some possibl ....

Density Functional Theory Dft , Dye Removal , Ethylene Blue Mb , Olydopamine Silver Pda Ag ,

DRDGOLD's Ergo and Wits lead the way to increased gold recovery

DRDGOLD’s Ergo Mining Proprietary Limited (Ergo) has entered into a second five-year (2022-2026) research and support agreement with the Wits University. Through the Gold Research Group in the School of Chemical and Metallurgical Engineering, the agreement will see continued research with the ob . ....

Herman Potgieter , Henry Gouws , School Of Chemical , Drdgold Ergo Mining Proprietary Limited , Wits University , Metallurgical Engineering At Wits University , Gold Research Group , Mining Proprietary Limited , Metallurgical Engineering , Professor Herman Potgieter , Alternative Leaching Technologies , Chemical Measurements And Modelling Technologies , Density Functional Theory Dft , Drdgolds Ergo And Wits Lead The Way To Increased Gold Recovery , Drdgolds Ergo Mining , Environmental Treatment Technologies , Fluidisation And Recovery Technology , Gold Research Group In The School Of Chemical And Metallurgical Engineering , Mining News ,