25 citations · 29 across the 3 of their papers we have counts for
3 papers
CrystalGRW: Generative Modeling of Crystal Structures with Targeted Properties via Geodesic Random Walks
Krit Tangsongcharoen, Teerachote Pakornchote, Chayanon Atthapak +6
Determining whether a candidate crystalline material is thermodynamically stable depends on identifying its true ground-state structure, a central challenge in computational materi…
StrainTensorNet: Predicting crystal structure elastic properties using SE(3)-equivariant graph neural networks
Teerachote Pakornchote, Annop Ektarawong, Thiparat Chotibut
Accurately predicting the elastic properties of crystalline solids is vital for computational materials science. However, traditional atomistic scale ab initio approaches are compu…
Roles of Nitrogen Substitution and Surface Reconstruction on StabilizingNon-passivated Single-layer Diamond
T. Pakornchote, A. Ektarawong, W. Busayaporn +2
Single-layer diamond or diamane is substituted by N atoms assisting the diamond-like structure to be stabilize without any passivation. One fourth of N substitution in diamane, ver…