日期:
2020 年 — 2026 年
2020
2021
2022
2023
2024
2025
2026
影响因子:

RetNeXt: A Pretrained Model for Transfer Learning Across the MOF Adsorption Space

RetNeXt:一种用于MOF吸附空间迁移学习的预训练模型

Sarikas, Antonios P; Gkagkas, Konstantinos; Froudakis, George E

Artificial Intelligence Paradigms for Next-Generation Metal-Organic Framework Research

面向下一代金属有机框架研究的人工智能范式

Ozcan, Aydin; Coudert, François-Xavier; Rogge, Sven M J; Heydenrych, Greta; Fan, Dong; Sarikas, Antonios P; Keskin, Seda; Maurin, Guillaume; Froudakis, George E; Wuttke, Stefan; Erucar, Ilknur

Assembly of Face Decorated Cuboidal Cages into Ultraporous Structures with Hierarchical Porosity: Accessing MOFs with the Awaited red-a Topology

将面修饰的立方体笼组装成具有分级孔隙率的超多孔结构:获得具有期待的红色拓扑结构的金属有机框架(MOF)。

Froudas, Konstantinos G; Tsangarakis, Constantinos; Montagnon, Tamsyn; Livas, Charalampos; Klontzas, Emmanuel; Froudakis, George E; Tampaxis, Christos; Charalambopoulou, Georgia; Steriotis, Theodore A; Trikalitis, Pantelis N

MOFSynth: A Computational Tool toward Synthetic Likelihood Predictions of MOFs

MOFSynth:一种用于预测金属有机框架(MOF)合成可能性的计算工具

Livas, Charalampos G; Trikalitis, Pantelis N; Froudakis, George E

Gas adsorption meets deep learning: voxelizing the potential energy surface of metal-organic frameworks

气体吸附与深度学习的结合:金属有机框架势能面的体素化

Sarikas, Antonios P; Gkagkas, Konstantinos; Froudakis, George E

Gas adsorption meets geometric deep learning: points, set and match

气体吸附与几何深度学习:点、集合和匹配

Sarikas, Antonios P; Gkagkas, Konstantinos; Froudakis, George E

Polyimides as Promising Cathodes for Metal-Organic Batteries: A Comparison between Divalent (Ca(2+), Mg(2+)) and Monovalent (Li(+), Na(+)) Cations

聚酰亚胺作为金属有机电池的潜在正极材料:二价阳离子(Ca²⁺、Mg²⁺)与一价阳离子(Li⁺、Na⁺)的比较

Monti, Damien; Patil, Nagaraj; Black, Ashley P; Raptis, Dionysios; Mavrandonakis, Andreas; Froudakis, George E; Yousef, Ibraheem; Goujon, Nicolas; Mecerreyes, David; Marcilla, Rebeca; Ponrouch, Alexandre

Multiscale Theoretical Study of Sulfur Dioxide (SO(2)) Adsorption in Metal-Organic Frameworks

金属有机框架中二氧化硫(SO(2))吸附的多尺度理论研究

Livas, Charalampos G; Raptis, Dionysios; Tylianakis, Emmanuel; Froudakis, George E

Data-driven prediction of in situ CO(2) foam strength for enhanced oil recovery and carbon sequestration

基于数据的原位CO₂泡沫强度预测及其在提高石油采收率和碳封存中的应用

Iskandarov, Javad; Fanourgakis, George S; Ahmed, Shehzad; Alameri, Waleed; Froudakis, George E; Karanikolos, Georgios N