Unifying machine learning and quantum chemistry with a deep neural network for molecular wavefunctions
K. T. Schütt, M. Gastegger, A. Tkatchenko et al. · Nature Communications · 2019
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Materials Chemistry
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115 papers1 CorrectedQuestions on this topic
Unraveling the coordination structure-performance relationship in Pt1/Fe2O3 single-atom catalyst
Yujing Ren, Yan Tang, Leilei Zhang et al. · Nature Communications · 2019
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Mesoporous Silica Nanoparticles for Protein Protection and Delivery
Chun Xu, Chang Lei, Chengzhong Yu · Frontiers in Chemistry · 2019 · Review
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Defect engineered bioactive transition metals dichalcogenides quantum dots
Xianguang Ding, Fei Peng, Jun Zhou et al. · Nature Communications · 2019
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On the degradation mechanisms of quantum-dot light-emitting diodes
Song Chen, Weiran Cao, Taili Liu et al. · Nature Communications · 2019
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Photoresponsive Luminescent Polymeric Hydrogels for Reversible Information Encryption and Decryption
Zhiqiang Li, Hongzhong Chen, Bin Li et al. · Advanced Science · 2019
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eg occupancy as an effective descriptor for the catalytic activity of perovskite oxide-based peroxidase mimics
Xiaoyu Wang, Xuejiao J. Gao, Li Qin et al. · Nature Communications · 2019
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Approaching coupled cluster accuracy with a general-purpose neural network potential through transfer learning
Justin S. Smith, Benjamin T. Nebgen, Roman Zubatyuk et al. · Nature Communications · 2019
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Two-dimensional semiconducting covalent organic frameworks via condensation at arylmethyl carbon atoms
Shuai Bi, Can Yang, Wenbei Zhang et al. · Nature Communications · 2019
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Ultralong UV/mechano-excited room temperature phosphorescence from purely organic cluster excitons
Xuepeng Zhang, Lili Du, Weijun Zhao et al. · Nature Communications · 2019
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Covalent organic framework membranes through a mixed-dimensional assembly for molecular separations
Hao Yang, Leixin Yang, Hongjian Wang et al. · Nature Communications · 2019
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Structural Characterization of Graphene Oxide: Surface Functional Groups and Fractionated Oxidative Debris
Elvin Aliyev, Volkan Filiz, Muntazim M. Khan et al. · Nanomaterials · 2019
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Titanium–Tissue Interface Reaction and Its Control With Surface Treatment
Takao Hanawa · Frontiers in Bioengineering and Biotechnology · 2019 · Review
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Ligand design strategies to increase stability of gadolinium-based magnetic resonance imaging contrast agents
Thomas J. Clough, Lijun Jiang, Ka-Leung Wong et al. · Nature Communications · 2019 · Review
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Bactericidal and Cytotoxic Properties of Silver Nanoparticles
Chengzhu Liao, Yuchao Li, Sie Chin Tjong · International Journal of Molecular Sciences · 2019 · Review
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Boosting the efficiency of organic persistent room-temperature phosphorescence by intramolecular triplet-triplet energy transfer
Weijun Zhao, Tsz Shing Cheung, Nan Jiang et al. · Nature Communications · 2019
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Antimicrobial Silver Nanoparticles for Wound Healing Application: Progress and Future Trends
Federica Paladini, Mauro Pollini · Materials · 2019 · Review
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Cerium Oxide Nanoparticles: A Brief Review of Their Synthesis Methods and Biomedical Applications
Atul Dhall, William Self · Antioxidants · 2018 · Review
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Hard magnetic properties in nanoflake van der Waals Fe3GeTe2
Cheng Tan, Jinhwan Lee, Soon-Gil Jung et al. · Nature Communications · 2018
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An AIEgen-based 3D covalent organic framework for white light-emitting diodes
Huimin Ding, Jian Li, Guohua Xie et al. · Nature Communications · 2018
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