85 citations · 85 across the 3 of their papers we have counts for
3 papers
Quest for high Tc in layered structures: the case of LiB
Matteo Calandra, Aleksey N. Kolmogorov, Stefano Curtarolo
Using electronic structure calculation we study the superconducting properties of the theoretically-devised superconductor MS1-LiB (LiB). We calculate the electron-phonon coupling…
Theoretical study of the thermal behavior of free and alumina-supported Fe-C nanoparticles
Aiqin Jiang, Neha Awasthi, Aleksey N. Kolmogorov +5
The thermal behavior of free and alumina-supported iron-carbon nanoparticles is investigated via molecular dynamics simulations, in which the effect of the substrate is treated wit…
High-throughput ab initio analysis of the Bi-In, Bi-Mg, Bi-Sb, In-Mg, In-Sb, and Mg-Sb systems
Stefano Curtarolo, Aleksey N. Kolmogorov, Franklin Hadley Cocks
Prediction and characterization of crystal structures of alloys are a key problem in materials research. Using high-throughput ab initio calculations we explore the low-temperature…