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Optimal migration path of Ag in HfO_2: A first-principles study
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作者 代月花 陈真 +2 位作者 金波 李宁 李晓风 《Chinese Physics B》 SCIE EI CAS CSCD 2015年第7期193-199,共7页
First-principles calculations are used to investigate the migration path of Ag in the HfO2-based resistive random access memory(Re RAM). The formation energy calculation suggests that there are two different sites(... First-principles calculations are used to investigate the migration path of Ag in the HfO2-based resistive random access memory(Re RAM). The formation energy calculation suggests that there are two different sites(site 1 and site 3) for the incorporation of Ag atoms into the HfO2 unit cell. Thermodynamic analysis shows that the motion of Ag atom in the HfO2 supercell appears to be anisotropic, which is due to the fact that the Ag atom at site 3 moves along the [1ˉ11] orientation,but the Ag atom at site 1 moves along the [001] orientation. The migration barriers of the Ag atoms hopping between neighboring unit cells are calculated along five different orientations. Difficulty in producing motion of the Ag atom varies with the migration barrier: this motion is minimized along [1ˉ11] orientation. Furthermore, The optimal circulation path for Ag migration within the HfO2 supercells is obtained, and is found to be approximately along the [1ˉ11] orientation.Therefore, it is proposed that the positive voltage should be applied along this orientation, the conduction filament may form more easily, which could improve the response time and reduce the power consumption in Re RAM applications. 展开更多
关键词 HFO2 resistive random access memory ag migration migration orientation
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A novel transformer-embedded lithium-ion battery model for joint estimation of state-of-charge and state-of-health
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作者 Shang-Yu Zhao Kai Ou +3 位作者 Xing-Xing Gu Zhi-Min Dan Jiu-Jun Zhang Ya-Xiong Wang 《Rare Metals》 SCIE EI CAS CSCD 2024年第11期5637-5651,共15页
The state-of-charge(SOC)and state-of-health(SOH)of lithium-ion batteries affect their operating performance and safety.The coupled SOC and SOH are difficult to estimate adaptively in multi-temperatures and aging.This ... The state-of-charge(SOC)and state-of-health(SOH)of lithium-ion batteries affect their operating performance and safety.The coupled SOC and SOH are difficult to estimate adaptively in multi-temperatures and aging.This paper proposes a novel transformer-embedded lithium-ion battery model for joint estimation of state-ofcharge and state-of-health.The battery model is formulated across temperatures and aging,which provides accurate feedback for unscented Kalman filter-based SOC estimation and aging information.The open-circuit voltages(OCVs)are corrected globally by the temporal convolutional network with accurate OCVs in time-sliding windows.Arrhenius equation is combined with estimated SOH for temperature-aging migration.A novel transformer model is introduced,which integrates multiscale attention with the transformer's encoder to incorporate SOC-voltage differential derived from battery model.This model simultaneously extracts local aging information from various sequences and aging channels using a self-attention and depth-separate convolution.By leveraging multi-head attention,the model establishes information dependency relationships across different aging levels,enabling rapid and precise SOH estimation.Specifically,the root mean square error for SOC and SOH under conditions of 15℃dynamic stress test and 25℃constant current cycling was less than 0.9%and 0.8%,respectively.Notably,the proposed method exhibits excellent adaptability to varying temperature and aging conditions,accurately estimating SOC and SOH. 展开更多
关键词 State-of-charge(SOC) State-of-health(SOH) Global correction Temperature aging migration TRANSFORMER Multiscale attention
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