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275篇 您的检索式:作者名="Zurek"
    题名 作者 年代 出处 被引量
1Predicting superhard materials via a machine learning informed evolutionary structure search显示文摘The computational prediction of superhard materials would enable the in silico design of compounds that could be used in a wide variety of technological applications.Herein,good agreement was found between experimental Vickers hardnesses,Hv,of a wide range of materials and those calculated by three macroscopic hardness models that employ the shear and/or bulk moduli obtained from:(i)first principles via AFLOW-AEL(AFLOW Automatic Elastic Library),and(ii)a machine learning(ML)model trained on materials within the AFLOW repository.Because H^(ML)_(v) values can be quickly estimated,they can be used in conjunction with an evolutionary search to predict stable,superhard materials.This methodology is implemented in the XTALOPT evolutionary algorithm.Each crystal is minimized to the nearest local minimum,and its Vickers hardness is computed via a linear relationship with the shear modulus discovered by Teter.Both the energy/enthalpy and H^(ML)_(v),Teter are employed to determine a structure’s fitness.This implementation is applied towards the carbon system,and 43 new superhard phases are found.A topological analysis reveals that phases estimated to be slightly harder than diamond contain a substantial fraction of diamond and/or lonsdaleite.Patrick Avery Xiaoyu Wang Corey Oses Eric Gossett Davide M.Proserpio Cormac Toher Stefano Curtarolo Eva Zurek 2019npj Computational Materials2019,,1:7
2Calculation of the mean path length of the Epstein frame under nonsinusoidal excitations using the double Epstein method 显示文摘Marketos P Zurek S Moses A J 2008J Magn Magn Mater2008,320,20:1
3A Single Quantum Can-not be Cloned显示文摘 Zurek W H 1982Nature1982,299,:1
4Quantum discord: a measure of the quantumness of correlations显示文摘H Ollivier W H Zurek 2002Phys Rev Lett2002,88,1:1
5Boric Acid Dust as a Component of an Integrated Cockroach Management Program in Confined Swine Production显示文摘 Gore JC Stringham SM 2003J Econ Entomol2003,96,4:1
6HPLC-APCI-MS with calibration based on stable isotope-labelled internal standards for the quantification of carbonyls in air samples显示文摘ZUREK G LUFTMANN H KARST U 1999Analyst1999,124,9:1
7Damage evolution in ductile metals显示文摘Zurek A K Thissell W R Trujillo C P 2003Los Alamos Science2003,28,:1
8A method for defining the mean path length of Epstein frame 显示文摘Marketos P Zurek S Moses A 2007IEEE Trans Magn2007,43,6:1
9Water Solutions of Boric Acid and Sugar for Management of German Cockroach Populations in Livestock Production Systems显示文摘 Zurek L Santangelo LRG 2004J Econ Entomol2004,97,2:1
10Quantum discord: a measure of the quantumness of correlations显示文摘Ollivier H Zurek W H 2001Phys Rev Lett2001,88,1:1
11Liquid chromatography-mass spectrometry method for the determination of aldehydes derivatized by the Hantzsch reaction 显示文摘ZUREK G KARST U 1999Journal of Chromatography A1999,864,2:1
12A single quantum cannot be cloned显示文摘Wootters W K Zurek W H 1982Nature1982,,299:1
13Auditory target detection in reverberation显示文摘Zurek P M Freyman R L Balakrishnan U 2004J Acoust Soc Am2004,115,4:1
14A single quantum cannot be cloned 显示文摘Wootters W K Zurek W H 1982Nature (London)1982,299,:1
15Determination of acetaldehyde in tobac- co smoke using N-methyl-4-hydrazino-7-nitrobenzofurazan and liquid chromatography/mass spectrometry 显示文摘ZUREK G B~LDT A KARST U 2000Fresenius Journal of Analytical Chemistry2000,366,4:1
16Alpha5GABAA receptor activity sets the threshold for long- term potentiation and constrains hippoeampus-dependent memory显示文摘MARTIN L J ZUREK A A MACDONALD J F 2010J Neurosei2010,30,15:1
17Quantum discord:a measure of the quantumness of correlations显示文摘Olliver H Zurek W H 2001Phys Rev Lett2001,88,01:1
18Determination of carbonyls using hq- uid chromatography-mass spectrometry with atmospheric pressure chemi- cal ionization 显示文摘KEMtrlER C ZUREK G KARST U 1999Journal of Environmental Monitoring1999,1,4:1
19Anomalous temperature depend- ence of oxidation kinetics during steam oxidation of ferritic steels in the temperature range 550 -650~C 显示文摘Zurek J Wessel E Niewolak L 2004Corrosion Science2004,,46:1
20A single quantum cannot be cloned显示文摘Wootters W K Zurek W H 1982Nature1982,299,:1
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