most citedLeveraging Domain Adaptation for Accurate Machine Learning Predictions of New Halide Perovskites

2 citations · 2 across the 2 of their papers we have counts for

collaborators

2 papers

cond-mat.mtrl-sci2026

uFlowCSP: Crystal Structure Prediction using Mean flow generative models

Sourin Dey, Dipannoy Das Gupta, Lai Wei +2

Crystal structure prediction (CSP) is fundamental to computational materials discovery. Generative models including CDVAE, DiffCSP, FlowMM, and CrystalFlow learn stable-crystal dis…

cond-mat.mtrl-sci2024★ 2 cited

Leveraging Domain Adaptation for Accurate Machine Learning Predictions of New Halide Perovskites

Dipannoy Das Gupta, Zachary J. L. Bare, Suxuen Yew +5

We combine graph neural networks (GNN) with an inexpensive and reliable structure generation approach based on the bond-valence method (BVM) to train accurate machine learning mode…