A quantum chemistry dataset containing ground-state and conical-intersection structures of 260k molecules

Fuente: arXiv

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Bibliographic Details
Main Authors:	Zhang, Jiahui, Zhu, Yifei, Feng, Chuqiao, Ma, Yingjin, Xu, Chao, Lan, Zhenggang
Format:	Preprint
Published:	2026
Subjects:	Chemical Physics
Online Access:	Acceder al recurso
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Internet

https://arxiv.org/abs/2605.14287