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20202022
most citedInverse design of crystal structures for multicomponent systems

4 citations · 7 across the 7 of their papers we have counts for

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cond-mat.mtrl-sci2022

Thermodynamical and topological properties of metastable Fe3Sn

Ilias Samathrakis, Chen Shen, Kun Hu +5

Combining experimental data, first-principles calculations, and Calphad assessment, thermodynamic and topological transport properties of the Fe-Sn system were investigated. Densit…

cond-mat.mtrl-sci2022

The synergistic modulation of electronic and geometry structures leads to ultra-low thermal conductivity of graphene-like borides (g-B3X5, X=N, P, As)

Linfeng Yu, Jinyuan Xu, Chen Shen +6

The design of novel devices with specific technical interests through modulating structural properties and bonding characteristics promotes the vigorous development of materials in…

cond-mat.mtrl-sci2021

Giant anomalous Hall and anomalous Nernst Conductivities in Antiperovskites and their Tunability via Magnetic Fields

Harish K. Singh, Ilias Samathrakis, Chen Shen +1

The anomalous Hall conductivity (AHC) and anomalous Nernst conductivity (ANC) are two prominent transport phenomena in ferromagnetic materials of a topological nature. Based on fir…

cond-mat.mtrl-sci20211 cited

Anomalously low thermal conductivity of two-dimensional GaP monolayers: A comparative study of the group GaX (X = N, P, As)

Chen Shen, Niloofar Hadaeghi, Harish K. Singh +4

With the successful synthesis of the two-dimensional (2D) gallium nitride (GaN) in a planar honeycomb structure, the phonon transport properties of 2D GaN have been reported. Howev…

cond-mat.mtrl-sci20214 cited

Inverse design of crystal structures for multicomponent systems

Teng Long, Yixuan Zhang, Nuno M. Fortunato +3

We developed an inverse design framework enabling automated generation of stable multi-component crystal structures by optimizing the formation energies in the latent space based o…

cond-mat.mtrl-sci2020

Thermal conductivity of h-BN monolayers using machine learning interatomic potential

Yixuan Zhang, Chen Shen, Teng Long +1

Thermal management materials are of critical importance for engineering miniaturized electronic devices, where theoretical design of such materials demands the evaluation of therma…