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Materials Science 论文解读
Materials Science 领域重要论文的 AI 解读列表，按研究动机、方法与结果结构化呈现。
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5,071 results
Charge and spin instabilities in superconducting La$_3$Ni$_2$O$_7$
Xuejiao Chen, Peiheng Jiang, +3
arXiv (Cornell University)
|
2023
|
27 citations
ComENet: Towards Complete and Efficient Message Passing for 3D Molecular Graphs
Limei Wang, Yi Liu, +3
arXiv (Cornell University)
|
2022
|
27 citations
DPA-1: Pretraining of Attention-based Deep Potential Model for Molecular Simulation
Duo Zhang, Hangrui Bi, +4
arXiv (Cornell University)
|
2022
|
27 citations
Emergence of high-temperature superconducting phase in the pressurized La3Ni2O7 crystals
Jun Hou, Pengtao Yang, +13
arXiv (Cornell University)
|
2023
|
27 citations
Enhancing automated reaction discovery with boxed molecular dynamics in energy space
Rafael A. Jara‐Toro, Gustavo A. Pino, +3
arXiv (Cornell University)
|
2019
|
27 citations
Generating equilibrium molecules with deep neural networks
Niklas W. A. Gebauer, Michael Gastegger, +1
arXiv (Cornell University)
|
2018
|
27 citations
Learning Graph Models for Template-Free Retrosynthesis.
Vignesh Ram Somnath, Charlotte Bunne, +3
arXiv (Cornell University)
|
2020
|
27 citations
Magic Graphene Clusters Formation in the graphene CVD growth process on Ru and Rh
Junfeng Gao, Feng Ding
arXiv (Cornell University)
|
2017
|
27 citations
Predicting Berborite as Potential Deep-Ultraviolet Nonlinear Optical Crystal from First Principles
Lei Kang, Pifu Gong, +2
arXiv (Cornell University)
|
2020
|
27 citations
Quasi-dark Mode in a Metamaterial for Analogous Electromagnetically-induced Transparency
Vu Tran Thanh Thuy, Nguyễn Thanh Tùng, +4
arXiv (Cornell University)
|
2010
|
27 citations
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