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From individual elements to macroscopic materials: in search of new superconductors via machine learning 被引量:1
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作者 Claudio Pereti Kevin Bernot +5 位作者 Thierry Guizouarn František Laufek Anna Vymazalová Luca Bindi Roberta Sessoli Duccio Fanelli 《npj Computational Materials》 SCIE EI CSCD 2023年第1期1640-1648,共9页
An approach to supervised classification and regression of superconductive materials is proposed which builds on the DeepSet technology.This enables us to provide the chemical constituents of the examined compounds as... An approach to supervised classification and regression of superconductive materials is proposed which builds on the DeepSet technology.This enables us to provide the chemical constituents of the examined compounds as an input to the algorithm,while avoiding artefacts that could originate from the chosen ordering in the list.The performance of the method are successfully challenged for both classification(tag a given material as superconducting)and regression(quantifying the associated critical temperature).We then searched through the International Mineralogical Association list with the trained neural network.Among the obtained superconducting candidates,three materials were selected to undergo a thorough experimental characterization.Superconductivity has been indeed confirmed for the synthetic analogue of michenerite,PdBiTe,and observed for the first time in monchetundraite,Pd2NiTe2,at critical temperatures in good agreement with the theory predictions.This latter is the first certified superconducting material to be identified by artificial intelligence methodologies. 展开更多
关键词 artificial Deep NEURAL
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Room-Temperature Electroreductiveα-Alkylation of N-Heteroarenes with Styrenes
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作者 Maorui Wang Chengqian Zhang +3 位作者 He Zhao Huanfeng Jiang Pierre HDixneuf Min Zhang 《CCS Chemistry》 CSCD 2024年第2期342-352,共11页
Despite their interesting applications,direct and diverse syntheses of aryl-fused 2-alkyl cyclic amines still remain challenging.Here,the concept of incorporating a C–C coupling process into the N-heteroaryl reductio... Despite their interesting applications,direct and diverse syntheses of aryl-fused 2-alkyl cyclic amines still remain challenging.Here,the concept of incorporating a C–C coupling process into the N-heteroaryl reduction was successfully applied to fulfill such a synthetic purpose.Due to our use of controllable electroreduction coupled with proton abstraction,we can report a room-temperature reductiveα-alkylation of the inert N-heteroarenes with abundantly available styrenes in an undivided Zn(+)/C(−)cell.This proceeds with good substrate compatibility and operational simplicity,utilizes cost-effective sacrificial Zn-anode,exhibits high selectivity,and does not need pressurized H2 gas and transition-metal catalysts.This current work offers a useful platform for direct construction of valuable aryl-fused 2-alkyl cyclic amines that are difficult to access with conventional methods. 展开更多
关键词 electroreductive C-C cross-coupling N-heteroarenes STYRENES 2-alkyl cyclic amines ALKYLATION
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Silicon photonics phase and intensity modulators for flat frequency comb generation 被引量:1
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作者 LUCAS DENIEL ERWAN WECKENMANN +7 位作者 DIEGO PÉREZ GALACHO CHRISTIAN LAFFORGUE STÉPHANE MONFRAY CARLOS ALONSO-RAMOS LAURENT BRAMERIE FRÉDÉRIC BOEUF LAURENT VIVEN DELPHINE MARRIS-MORINI 《Photonics Research》 SCIE EI CAS CSCD 2021年第10期2068-2076,共9页
Flat electro-optical frequency combs play an important role in a wide range of applications,such as metrology,spectroscopy,or microwave photonics.As a key technology for the integration of optical circuits,silicon pho... Flat electro-optical frequency combs play an important role in a wide range of applications,such as metrology,spectroscopy,or microwave photonics.As a key technology for the integration of optical circuits,silicon photonics could benefit from on-chip,tunable,flat frequency comb generators.In this article,two different architectures based on silicon modulators are studied for this purpose.They rely on a time to frequency conversion principle to shape the comb envelope.Using a numerical model of the silicon traveling-wave phase modulators,their driving schemes are optimized before their performances are simulated and compared.A total of nine lines could be obtained within a 2 dB flatness,with a line-spacing ranging from 0.1 to 7 GHz.Since this tunability is a major asset of electro-optical frequency combs,the effect of segmenting the phase modulators is finally investigated,showing that the flat lines spacing could be extended up to 39 GHz by this method. 展开更多
关键词 PHASE SPACING METROLOGY
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Quadratic mean-field reflected BSDEs
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作者 Ying Hu Remi Moreau Falei Wang 《Probability, Uncertainty and Quantitative Risk》 2022年第3期169-194,共26页
In this paper,we analyze mean-field reflected backward stochastic differential equations when the driver has quadratic growth in the second unknown z.Using a linearization technique and the BMO martingale theory,we fi... In this paper,we analyze mean-field reflected backward stochastic differential equations when the driver has quadratic growth in the second unknown z.Using a linearization technique and the BMO martingale theory,we first apply a fixed-point argument to establish the uniqueness and existence result for the case with bounded terminal condition and obstacle.Then,with the help of theθ-method,we develop a successive approximation procedure to remove the boundedness condition on the terminal condition and obstacle when the generator is concave(or convex)with respect to the second unknown. 展开更多
关键词 MEAN-FIELD Reflected BSDEs Linearization technique θ-method
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