@article{constraineddiffusionforacceleratedstruct, title = {Constrained Diffusion for Accelerated Structure Relaxation of Inorganic Solids with Point Defects}, author = {Jingyi Cui and Jacob K. Christopher and Ankita Biswas and Prasanna V. Balachandran and Ferdinando Fioretto}, year = {2026}, eprint = {2602.19153}, archivePrefix = {arXiv}, url = {https://arxiv.org/abs/2602.19153}, }