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Generative Inverse Design of Crystal Structures via Diffusion Models
  with Transformers
v1v2 (latest)

Generative Inverse Design of Crystal Structures via Diffusion Models with Transformers

13 June 2024
Izumi Takahara
Kiyou Shibata
Teruyasu Mizoguchi
    DiffMAI4CE
ArXiv (abs)PDFHTMLGithub

Papers citing "Generative Inverse Design of Crystal Structures via Diffusion Models with Transformers"

3 / 3 papers shown
All that structure matches does not glitter
All that structure matches does not glitter
Maya M. Martirossyan
Thomas Egg
Philipp Hoellmer
George Karypis
Mark K. Transtrum
Adrian Roitberg
Mingjie Liu
Richard G. Hennig
E. Tadmor
Stefano Martiniani
208
4
0
15 Sep 2025
CrystalICL: Enabling In-Context Learning for Crystal Generation
CrystalICL: Enabling In-Context Learning for Crystal Generation
Ruobing Wang
Qiaoyu Tan
Yili Wang
Ying Wang
Xin Wang
198
3
0
27 Aug 2025
Design Topological Materials by Reinforcement Fine-Tuned Generative Model
Design Topological Materials by Reinforcement Fine-Tuned Generative Model
Haosheng Xu
Dongheng Qian
Zhixuan Liu
Yadong Jiang
Jing Wang
220
2
0
17 Apr 2025
1
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