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Direct calculation of effective mobile ion concentration in lithium superionic conductors
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作者 Bowei Pu Zheyi Zou +6 位作者 Jinping Liu Bing He Dezhi Chen Da Wang Yue Liu Maxim Avdeev Siqi Shi 《npj Computational Materials》 2025年第1期402-409,共8页
In the realm of lithium superionic conductors,pursuing higher ionic conductivity is imperative,with the variance in lithium-ion concentration playing a determining role.Due to the permanent and temporary site-blocking... In the realm of lithium superionic conductors,pursuing higher ionic conductivity is imperative,with the variance in lithium-ion concentration playing a determining role.Due to the permanent and temporary site-blocking effects,especially at non-dilute concentrations,not all Li-ions contribute to ionic conductivity.Here,we propose a strategy to directly calculate effective mobile ion concentration in which multiple-ion correlated migration is considered in the percolation analysis with the input of Li-ion distributions and hopping behavior based on kinetic Monte Carlo simulation,termed P-KMC.We provide examples of two representative lithium superionic conductors,cubic garnet-type LixA3B2O12(0≤x≤9;A and B represent different cations)and perovskite-type LixLa2/3−x/3TiO3(0≤x≤0.5),to demonstrate the direct dependence of the ionic conductivity on the effective mobile ion concentration.This methodology provides a robust tool to identify the optimal compositions for the highest ionic conductivity in superionic conductors. 展开更多
关键词 effective mobile ion concentration directly calculate effective mobile ion concentration percolation analysis lithium superionic conductorspursuing ionic conductivity kinetic monte carlo simulation ionic conductivityherewe lithium superionic conductors
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Reliability Analysis Based on a Direct Ship Hull Strength Assessment 被引量:1
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作者 Guoqing Feng Dongsheng Wang +1 位作者 Yordan Garbatov C. Guedes Soares 《Journal of Marine Science and Application》 CSCD 2015年第4期389-398,共10页
A method of reliability analysis based on a direct strength calculation employing the von Mises stress failure criterion is presented here. The short term strain distributions of ship hull structural components are id... A method of reliability analysis based on a direct strength calculation employing the von Mises stress failure criterion is presented here. The short term strain distributions of ship hull structural components are identified through the statistical analysis of the wave-induced strain history and the long term distributions by the weighted summation of the short term strain distributions. The wave-induced long term strain distribution is combined with the still water strain. The extreme strain distribution of the response strain is obtained by statistical analysis of the combined strains. The limit state function of the reliability analysis is based on the von Mises stress failure criterion, including the related uncertainties due to the quality of the material and model uncertainty. The reliability index is calculated using FORM and sensitivity analysis of each variable that has effects on the reliability is also discussed. 展开更多
关键词 ship hull yield stress ship structures reliability analysis direct calculation yon Mists stress failure criterion
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