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| 1 | Machine learning aided design of perovskite oxide materials for photocatalytic water splitting显示文摘Suffering from the inefficient traditional trial-and-error methods and the huge searching space filled by millions of candidates, discovering new perovskite visible photocatalysts with higher hydrogen production rate(RH_(2)) still remains a challenge in the field of photocatalytic water splitting(PWS). Herein, we established structural-property models targeted to RH_(2) and the proper bandgap(Eg) via machine learning(ML) technology to accelerate the discovery of efficient perovskite photocatalysts for PWS. The Pearson correlation coefficients(R) of leave-one-out cross validation(LOOCV) were adopted to compare the performances of different algorithms including gradient boosting regression(GBR), support vector regression(SVR), backpropagation artificial neural network(BPANN), and random forest(RF). It was found that the BPANN model showed the highest R values from LOOCV and testing data of 0.9897 and 0.9740 for RH_(2),while the GBR model had the best values of 0.9290 and 0.9207 for Eg. Furtherly, 14 potential PWS perovskite candidates were screened out from 30,000 ABO3-type perovskite structures under the criteria of structural stability, Eg, conduction band energy, valence band energy and RH_(2). The average RH_(2) of these14 perovskites is 6.4% higher than the highest value in the training data set. Moreover, the online web servers were developed to share our prediction models, which could be accessible in http://gffzz63fbdfd3a8d8472dhbfbbxoq05kkb6vff.ffgz.tsg.suse.edu.cn/ocpmdm/material_api/ahfga3d9puqlknig(E_g prediction) and http://gffzzb41aaebde6114c49hbfbbxoq05kkb6vff.ffgz.tsg.suse.edu.cn/ocpmdm/material_api/i0 ucuyn3 wsd14940(RH_(2) prediction). | Qiuling Tao Tian Lu Ye Sheng Long Li Wencong Lu Minjie Li | 2021 | Journal of Energy Chemistry2021，30，9： | 5 |
| 2 | Machine learning for perovskite materials design and discovery显示文摘The development of materials is one of the driving forces to accelerate modern scientific progress and technological innovation.Machine learning(ML)technology is rapidly developed in many fields and opening blueprints for the discovery and rational design of materials.In this review,we retrospected the latest applications of ML in assisting perovskites discovery.First,the development tendency of ML in perovskite materials publications in recent years was organized and analyzed.Second,the workflow of ML in perovskites discovery was introduced.Then the applications of ML in various properties of inorganic perovskites,hybrid organic–inorganic perovskites and double perovskites were briefly reviewed.In the end,we put forward suggestions on the future development prospects of ML in the field of perovskite materials. | Qiuling Tao Pengcheng Xu Minjie Li Wencong Lu | 2021 | npj Computational Materials2021，，1： | 4 |
| 3 | Refractive-diffractive visual system for micro-display of LCOS显示文摘One head-mounted display visual system for computer entertainment and three-dimensional display of virtual-reality was achieved, which consists of a hybrid re-fractive-diffractive eyepiece and a relay reflector. It can be used in micro-display of liquid crystal on silicon (LCOS) diagonal of 18 mm. The whole system has better performance, with 60° field of view, 10 mm exit pupil, 23 mm eye relief, and reduces weight and size. | ZHAO Qiuling WANG Zhaoqi MU Guoguang LU Zhenwu | 2002 | Chinese Science Bulletin2002，47，16： | 1 |
| 4 | Phase quantification of two chlorothalonil polymorphs by X-ray powder diffraction显示文摘 | LU Qiuling YANG Guang GU Hao | 2005 | Analytica Chimica Acta2005，538，7： | 1 |
| 5 | Ultrasound diagnosis about branchial cyst in parotid显示文摘 | Shi Qiuling Hui Luo Yang Jiao Tao Liu Jun Lu | 2014 | International English Education Research2014，，2： | 0 |
| 6 | An Olefinic 1,2-α-Boryl Migration Enables 1,2-Bis(boronic esters)via Radical-Polar Crossover Reaction显示文摘A radical-induced 1,2-α-boryl migration through radical polar crossover reactions has been described.In this work,in situ formed vinyldiboron“ate”complexes from alkenyl Grignard reagent and diborylalkanes react with commercial radical precursors under light initiation.This three-component process enables diborylation of alkene.This protocol features high atom economy,a broad substrate scope as well as good functional group toleration with mild conditions. | Feng Zhang Shangteng Liao Lu Zhou Kai Yang Chenglan Wang Yixian Lou Cece Wang Qiuling Song | 2022 | Chinese Journal of Chemistry2022，40，5： | 0 |
| 7 | Research progress of acupuncture analgesia based on autonomic nerve regulation pathway显示文摘The autonomic nervous system(ANS)includes the sympathetic,parasympathetic,and enteric nervous systems,and its senior regulatory center includes the brainstem,cingulate gyrus,and hypothalamus.Acupuncture can affect visceral,vascular,and glandular functions via the autonomic nervous regulatory pathway.In this paper,the relationship between pain and autonomic nervous function,the application of acupuncture guided by the autonomic nervous system,and the basis and clinical research on acupuncture analgesia are reviewed. | Lina Pang Xiaomei Chen Yanyan Lan Qiuling Huang Xiangmei Yu Lu Qi Zhifu Wang | 2023 | Acupuncture and Herbal Medicine2023，3，4： | 0 |
| 8 | Curcumin based combination therapy for anti-breast cancer: from in vitro drug screening to in vivo efficacy evaluation显示文摘当药抵抗看起来是在 monotherapy 的越来越多的 anticancer 药的一个不可避免的问题时,联合药治疗成为了一个繁荣的方法减少管理的全部的药剂量以及克服癌房间的药抵抗。Curcumin,考虑了作为 chemoresistance 的一块压板根据它的多重反肿瘤的机制在癌症治疗拥有 multifaceted 角色,能显著地便于它的反癌症功能并且改进经由联合用法与的治疗学的效果许多有不同反应机制的另外的药。探索这可能性,四反癌症都拥有药抵抗问题的某个度的化学疗法的代理人,包括三个酷氨酸 kinase 禁止者( erlotinib , sunitinib 和 sorafenib ),那对不同房间小径和典型 anticancer 药 doxorubicin 正在起作用,个别地与 curcumin 被相结合在 vitro 并且在 vivo 检验 synergistic 反肿瘤效果。结果表明在 0.46 的臼齿的比率与 curcumin 相结合的 sunitinib 在 vitro 产出大多数有势力 synergistic 效果,并且因此为进一步的动物评估被选择。为了推进,提高 anticancer 效果,牛的浆液白朊(BSA ) nanoparticles 作为一个搬运人被利用在 situ 交付选择的药联合。在证实的 vivo 调查结果初步我们能由我们的途径在测试动物为延长时间时期维持类似的注射的药比率的假设,从而最大化还最小化这些药的毒性的治疗学的力量。这个工作能在联合药治疗和实现上开创一条新大街如此的药的临床的用途。 | Sunhui Chen Qiuling Liang Shuping Xie Ergang Liu Zhili Yu Lu Sun Meong Cheol Shin Seung Jin Lee Huining He Victor C. Yang | 2016 | Frontiers of Chemical Science and Engineering2016，10，3： | 0 |
| 9 | Photoinduced NaI-Promoted Radical Borylation of Alkyl Halides and Pseudohalides显示文摘Main observation and conclusion A method for photoinduced NaI-promoted radical borylation of aliphatic halides and pseudohalides with bis(catecholato)diboron(B_(2)cat_(2))as the boron source is introduced.The borylation reaction is operationally simple and shows high functional group tolerance and broad substrate scope.Preliminary mechanistic studies suggest that the reaction proceeds through S_(N)2-based radical-generation strategy. | Chenglan Wang Lu Zhou Kai Yang Feng Zhang Qiuling Song | 2021 | Chinese Journal of Chemistry2021，39，7： | 0 |
| 10 | Atom Recombination of Difluorocarbene Enables 3-Fluorinated Oxindoles from 2-Aminoarylketones显示文摘Contrary to the traditional implementation as a difluoromethyl group and recently disclosed role of C1 synthons in synthetic organic chemistry,difluorocarbene(:CF_(2))is reported herein to proceed in unprecedented atom recombination as both a C1 synthon and F1 reagent simultaneously to render valuable 3-fluorinated oxindoles from 2-aminoarylketones.The reaction does not require catalyst and features a broad range of substrates with good functional group compatibility and ease of execution.This transformation could be employed to the quick-constructions of certain bioactive molecule derivatives.The mechanistic experiments and density functional theory(DFT)calculations indicate that this atom recombination reaction of:CF_(2) for the synthesis of 3-fluorinated oxindoles may involve a rearrangement process of epoxide intermediates. | Guan Zhang Qianqian Shi Mengyuan Hou Kai Yang Shihui Wang Shuai Wang Wangyang Li Chaokun Li Jian Qiu Hetao Xu Lu Zhou Cece Wang Shi-Jun Li Yu Lan Qiuling Song | 2022 | CCS Chemistry2022，4，5： | 0 |
| 11 | Rh-Catalyzed diastereoselective addition of arylboronic acids to α-keto N-tert-butanesulfinyl aldimines: synthesis of α-amino ketones显示文摘Herein we present a diastereoselective addition of arylboronic acids toα-keto N-tert-butanesulfinyl aldi-mines catalyzed by a Rh(I)catalyst.This reaction provides a practical method to obtain valuable chiralα-amino ketones with excellent diastereoselectivity,featuring operational simplicity,mild reaction con-ditions and a broad substrate scope. | Cece Wang Lu Zhou Jian Qiu Kai Yang Qiuling Song | 2022 | Organic Chemistry Frontiers2022，9，4： | 0 |
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