兰州大学机构库

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RetroPrime: A Diverse, plausible and Transformer-based method for Single-Step retrosynthesis predictions 期刊论文
CHEMICAL ENGINEERING JOURNAL, 2021, 卷号: 420
Authors:  Wang, Xiaorui;  Li, Yuquan;  Qiu, Jiezhong;  Chen, Guangyong;  Liu, HX(刘焕香);  Liao, Benben;  Hsieh, Chang-Yu;  Yao, XJ(姚小军)
Favorite  |  View/Download:20/0  |  Submit date:2021/08/12
Deep Learning  Natural Language Processing  Template-free Single-Step Retrosynthesis  
Turbulent/Synoptic Separation and Coherent Structures in the Atmospheric Surface Layer for a Range of Surface Roughness 期刊论文
BOUNDARY-LAYER METEOROLOGY, 2021
Authors:  Li, Xuebo;  Wang, Guohua;  Zheng, XJ(郑晓静)
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Atmospheric surface layer  Attached eddy hypothesis  Coherent structures  Roughness  Synoptic scale motion  
Dipole evoked hole-transporting material p-doping by utilizing organic salt for perovskite solar cells 期刊论文
Nano Energy, 2021, 卷号: 85
Authors:  Xia, Jianxing;  Zhang, Ruiling;  Luo, Junsheng;  Yang, Hua;  Shu, Hongyu;  Malik, Haseeb Ashraf;  Wan, Zhongquan;  Shi, Yu;  Han, Keli;  Wang, Ruilin...Xia, Jianxing;  Zhang, Ruiling;  Luo, Junsheng;  Yang, Hua;  Shu, Hongyu;  Malik, Haseeb Ashraf;  Wan, Zhongquan;  Shi, Yu;  Han, Keli;  Wang, Ruilin;  Yao, XJ(姚小军);  Jia, Chunyang
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Deep trap state  Dipole  Hetero-junction interface  Hole-transporting materials  Hydrophobics  Li$++$  Organic salt  P-doping  Trap state  Van der Waals radius  Deep trap state  Dipole  Hetero-junction interface  Hole-transporting materials  Hydrophobics  Li$++$  Organic salt  P-doping  Trap state  Van der Waals radius  
Ex-situ XPS analysis of yolk-shell Sb2O3/WO3 for ultra-fast acetone resistive sensor 期刊论文
Journal of Hazardous Materials, 2021, 卷号: 412
Authors:  Wang, Qiao;  Wu, Hongchang;  Wang, Yanrong;  Li, Jianpeng;  Yang, Yifan;  Cheng, Xu;  Luo, Yibing;  An, Beixi;  Pan, Xiaojun;  Xie, Erqing...Wang, Qiao;  Wu, Hongchang;  Wang, Yanrong;  Li, Jianpeng;  Yang, Yifan;  Cheng, Xu;  Luo, Yibing;  An, Beixi;  Pan, Xiaojun;  Xie, Erqing
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Acetone  Carrier mobility  Chemical detection  Diagnosis  Gas adsorption  Gas detectors  Gases  Heterojunctions  Oxygen vacancies  Shells (structures)  Tungsten compounds  X ray photoelectron spectroscopy  Adsorption and desorptions  Chemisorbed oxygen  Disease diagnosis  Gas sensing devices  Interfacial potential  Low detection limit  Transport of charge  Yolk-shell structures  
Introducing block design in graph neural networks for molecular properties prediction 期刊论文
Chemical Engineering Journal, 2021, 卷号: 414
Authors:  Li, Yuquan;  Li, Pengyong;  Yang, Xing;  Hsieh, Chang-Yu;  Zhang, Shengyu;  Wang, Xiaorui;  Lu, Ruiqiang;  Liu, HX(刘焕香);  Yao, XJ(姚小军)
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Deep learning  Graph algorithms  Large dataset  Learning systems  Neural networks  Quantum theory  Approximate solution  Bioactivity prediction  Graph neural networks  Learning process  Machine learning methods  Many-body quantum systems  Mean absolute error  Molecular properties  
The effects of Fe substrate orientations on Cu55 cluster deposition with different incident energies 期刊论文
Nuclear Instruments and Methods in Physics Research, Section B: Beam Interactions with Materials and Atoms, 2021, 卷号: 496, 页码: 52-60
Authors:  He, Yiwen;  Zhang, SX(张世旭);  He, Luanxuan;  Wang, Xuejian;  Zheng, Zhijun;  Liu, Huiwei;  Li, GP(李公平);  Zhang, HF(张鸿飞)
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Atomic density  Cluster deposition  Cu55 cluster  Dynamics simulation  Fe substrate  Incident energy  Influence mechanism  Substrate crystals  Substrate orientation  Surface atoms  Atomic density  Cluster deposition  Cu55 cluster  Dynamics simulation  Fe substrate  Incident energy  Influence mechanism  Substrate crystals  Substrate orientation  Surface atoms  
Study of coherent structures and heat flux transportation under different stratification stability conditions in the atmospheric surface layer 期刊论文
Physics of Fluids, 2021, 卷号: 33, 期号: 6
Authors:  Li, Xuebo;  Wang, Guohua;  Zheng, XJ(郑晓静)
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Atmospheric temperature  Atmospheric thermodynamics  Boundary layer flow  Buoyancy  Lakes  Reynolds number  Shear flow  Stability  Walls (structural partitions)  Atmospheric surface layers  High Reynolds number  Large scale structures  Large-scale coherent structures  Structure inclination angle  Temperature fluctuation  Threshold stability  Unstable conditions  
The effects of Fe substrate orientations on Cu-55 cluster deposition with different incident energies 期刊论文
NUCLEAR INSTRUMENTS & METHODS IN PHYSICS RESEARCH SECTION B-BEAM INTERACTIONS WITH MATERIALS AND ATOMS, 2021, 卷号: 496, 页码: 52-60
Authors:  He, Yiwen;  Zhang, SX(张世旭);  He, Luanxuan;  Wang, Xuejian;  Zheng, Zhijun;  Liu, Huiwei;  Li, GP(李公平);  Zhang, HF(张鸿飞)
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Molecular dynamics simulationCu-55 clusterDepositionCrystal orientationFe substrates  
Quantitative analysis of the relationship of derivatization reagents and detection sensitivity of electrospray ionization-triple quadrupole tandem mass spectrometry: Hydrazines as prototypes 期刊论文
ANALYTICA CHIMICA ACTA, 2021, 卷号: 1158
Authors:  Xiao, Hua-Ming;  Yang, Xing;  Zheng, Feng;  Tshepelevitsh, Sofja;  Wang, Xian;  Yao, XJ(姚小军);  Leito, Ivo;  Feng, Yu-Qi
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Derivatization reagentsDetection sensitivityElectrospray ionizationTriple quadrupole tandem massspectrometryQuantitative structure-activity relationship  
Modulation of turbulence by saltating particles on erodible bed surface 期刊论文
JOURNAL OF FLUID MECHANICS, 2021, 卷号: 918
Authors:  Zheng, XJ(郑晓静);  Feng, Shengjun;  Wang, P(王萍)
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multiphase flowturbulence simulationturbulent boundary layers