195 citations · 1.1k across the 25 of their papers we have counts for
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Designing of Magnetic MAB Phases for Energy Applications
Chen Shen, Qiang Gao, Nuno M. Fortunato +4
Based on high-throughput density functional theory calculations, we performed screening for stable magnetic MAB compounds and predicted potential strong magnets for permanent magne…
Constrained crystals deep convolutional generative adversarial network for the inverse design of crystal structures
Teng Long, Nuno M. Fortunato, Ingo Opahle +5
Autonomous materials discovery with desired properties is one of the ultimate goals for materials science, and the current studies have been focusing mostly on high-throughput scre…
Effect of N, C and B interstitials on the structural and magnetic properties of alloys with CuAu-structure
Ingo Opahle, Harish K. Singh, Jan Zemen +2
High-throughput density functional calculations are used to investigate the effect of interstitial B, C and N atoms on 21 alloys reported to crystallize in the cubic CuAu struc…