The ground roll and body wave usually show significant differences in arrival time, frequency content, and polarization characteristics, and conventional polarization filters that operate in either the time or frequen...The ground roll and body wave usually show significant differences in arrival time, frequency content, and polarization characteristics, and conventional polarization filters that operate in either the time or frequency domain cannot consider all these elements. Therefore, we have developed a time-frequency dependent polarization filter based on the S transform to attenuate the ground roll in seismic records. Our approach adopts the complex coefficients of the S transform of the multi-component seismic data to estimate the local polarization attributes and utilizes the estimated attributes to construct the filter function. In this study, we select the S transform to design this polarization filter because its scalable window length can ensure the same number of cycles of a Fourier sinusoid, thereby rendering more precise estimation of local polarization attributes. The results of applying our approach in synthetic and real data examples demonstrate that the proposed polarization filter can effectively attenuate the ground roll and successfully preserve the body wave.展开更多
以赵家寨煤矿为例,对叠前地震数据进行滤波、超道集、保幅等一系列处理,得到高信噪比的叠前地震数据,进而计算出多种AVO(振幅随偏移距的变化Amplitude Versus Offset)属性。通过多种AVO属性与实际钻孔含气量的线性分析,认为极化量属性(...以赵家寨煤矿为例,对叠前地震数据进行滤波、超道集、保幅等一系列处理,得到高信噪比的叠前地震数据,进而计算出多种AVO(振幅随偏移距的变化Amplitude Versus Offset)属性。通过多种AVO属性与实际钻孔含气量的线性分析,认为极化量属性(PM)具有较好的相关性。对PM属性进行Kriging内插值,最终得到勘探区煤层含气量分布。为验证AVO反演预测煤层瓦斯富集区的准确性,选取矿区14采区18个钻孔进行对比,结果表明,预测的瓦斯含量平均误差为0.95%,最大误差也小于1.5%,均在误差范围内,可见利用AVO反演能够比较准确的圈定瓦斯富集区。展开更多
Electrolytes are widely considered as a key component in Li–O;batteries (LOBs) because they greatly affect the discharge-charge reaction kinetics and reversibility.Herein,we report that 1,3-dimethyl-2-imidazolidinone...Electrolytes are widely considered as a key component in Li–O;batteries (LOBs) because they greatly affect the discharge-charge reaction kinetics and reversibility.Herein,we report that 1,3-dimethyl-2-imidazolidinone (DMI) is an excellent electrolyte solvent for LOBs.Comparing with conventional ether and sulfone based electrolytes,it has higher Li_(2)O_(2)and Li_(2)CO_(3)solubility,which on the one hand depresses cathode passivation during discharge,and on the other hand promotes the liquid-phase redox shuttling during charge,and consequently lowers the overpotential and improves the cyclability of the battery.However,despite the many advantages at the cathode side,DMI is not stable with bare Li anode.Thus,we have developed a pretreatment method to grow a protective artificial solid-state electrolyte interface(SEI) to prevent the unfavorable side-reactions on Li.The SEI film was formed via the reaction between fluorine-rich organic reagents and Li metal.It is composed of highly Li^(+)-conducting Li_(x)BO_(y),LiF,Li_(x)NO_(y),Li_(3)N particles and some organic compounds,in which Li_(x)BO_(y)serves as a binder to enhance its mechanical strength.With the protective SEI,the coulombic efficiency of Li plating/stripping in DMI electrolyte increased from 20%to 98.5%and the fixed capacity cycle life of the assembled LOB was elongated to205 rounds,which was almost fivefold of the cycle life in dimethyl sulfoxide (DMSO) or tetraglyme(TEGDME) based electrolytes.Our work demonstrates that molecular polarity and ionic solvation structure are the primary issues to be considered when designing high performance Li–O;battery electrolytes,and cross-linked artificial SEI is effective in improving the anodic stability.展开更多
Ferroelectricity and metallicity are usually believed not to coexist because conducting electrons would screen out static internal electric fields.In 1965,Anderson and Blount proposed the concept of"ferroelectric...Ferroelectricity and metallicity are usually believed not to coexist because conducting electrons would screen out static internal electric fields.In 1965,Anderson and Blount proposed the concept of"ferroelectric metal",however,it is only until recently that very rare ferroelectric metals were reported.Here,by combining high-throughput ab initio calculations and data-driven machine learning method with new electronic orbital based descriptors,we systematically investigated a large family(2964)of two-dimensional(2D)bimetal phosphates,and discovered 60 stable ferroelectrics with out-of-plane polarization,including 16 ferroelectric metals and 44 ferroelectric semiconductors that contain seven multiferroics.The ferroelectricity origins from spontaneous symmetry breaking induced by the opposite displacements of bimetal atoms,and the full-d-orbital coinage metal elements cause larger displacements and polarization than other elements.For 2D ferroelectric metals,the odd electrons per unit cell without spin polarization may lead to a half-filled energy band around Fermi level and is responsible for the metallicity.It is revealed that the conducting electrons mainly move on a single-side surface of the 2D layer,while both the ionic and electric contributions to polarization come from the other side and are vertical to the above layer,thereby causing the coexistence of metallicity and ferroelectricity.Van der Waals heterostructures based on ferroelectric metals may enable the change of Schottky barrier height or the Schottky-Ohmic contact type and induce a dramatic change of their vertical transport properties.Our work greatly expands the family of 2D ferroelectric metals and will spur further exploration of 2D ferroelectric metals.展开更多
We present a first-principles theoretical study of electric field- and straincontrolled intrinsic half-metallic properties of zigzagged aluminium nitride (A1N) nanoribbons. We show that the half-metallic property of...We present a first-principles theoretical study of electric field- and straincontrolled intrinsic half-metallic properties of zigzagged aluminium nitride (A1N) nanoribbons. We show that the half-metallic property of AIN ribbons can undergo a transition into fully-metallic or semiconducting behavior with application of an electric field or uniaxial strain. An external transverse electric field induces a full charge screening that renders the material semiconducting. In contrast, as uniaxial strain varies from compressive to tensile, a spin-resolved selective self-doping increases the half-metallic character of the ribbons. The relevant strain-induced changes in electronic properties arise from band structure modifications at the Fermi level as a consequence of a spin-polarized charge transfer between p-orbitals of the N and A1 edge atoms in a spin-resolved self-doping process. This band structure tunability indicates the possibility of designing magnetic nanoribbons with tunable electronic structure by deriving edge states from elements with sufficiently different localization properties. Finite temperature molecular dynamics reveal a thermally stable half-metallic nanoribbon up to room temperature.展开更多
Intercalation transition metal oxides (ITMO)have attracted great attention as lithium-ion battery negative electrodes due to high operation safety,high capacity and rapid ion intercalation.However,the intrinsic low el...Intercalation transition metal oxides (ITMO)have attracted great attention as lithium-ion battery negative electrodes due to high operation safety,high capacity and rapid ion intercalation.However,the intrinsic low electron conductivity plagues the lifetime and cell performance of the ITMO negative electrode.Here we design a new carbon-emcoating architecture through single CO_(2)activation treatment as demonstrated by the Nb_(2)O_(5)/C nanohybrid.Triple structure engineering of the carbon-emcoating Nb_(2)O_(5)/C nanohybrid is achieved in terms of porosity,composition,and crystallographic phase.The carbon-embedding Nb_(2)O_(5)/C nanohybrids show superior cycling and rate performance compared with the conventional carbon coating,with reversible capacity of 387 m A h g(-1)at 0.2 C and 92%of capacity retained after 500cycles at 1 C.Differential electrochemical mass spectrometry(DEMS) indicates that the carbon emcoated Nb_(2)O_(5)nanohybrids present less gas evolution than commercial lithium titanate oxide during cycling.The unique carbon-emcoating technique can be universally applied to other ITMO negative electrodes to achieve high electrochemical performance.展开更多
基金supported by the National Science and Technology Major Project of China(Grant No.2011ZX05014 and 2011ZX05008-005)
文摘The ground roll and body wave usually show significant differences in arrival time, frequency content, and polarization characteristics, and conventional polarization filters that operate in either the time or frequency domain cannot consider all these elements. Therefore, we have developed a time-frequency dependent polarization filter based on the S transform to attenuate the ground roll in seismic records. Our approach adopts the complex coefficients of the S transform of the multi-component seismic data to estimate the local polarization attributes and utilizes the estimated attributes to construct the filter function. In this study, we select the S transform to design this polarization filter because its scalable window length can ensure the same number of cycles of a Fourier sinusoid, thereby rendering more precise estimation of local polarization attributes. The results of applying our approach in synthetic and real data examples demonstrate that the proposed polarization filter can effectively attenuate the ground roll and successfully preserve the body wave.
文摘以赵家寨煤矿为例,对叠前地震数据进行滤波、超道集、保幅等一系列处理,得到高信噪比的叠前地震数据,进而计算出多种AVO(振幅随偏移距的变化Amplitude Versus Offset)属性。通过多种AVO属性与实际钻孔含气量的线性分析,认为极化量属性(PM)具有较好的相关性。对PM属性进行Kriging内插值,最终得到勘探区煤层含气量分布。为验证AVO反演预测煤层瓦斯富集区的准确性,选取矿区14采区18个钻孔进行对比,结果表明,预测的瓦斯含量平均误差为0.95%,最大误差也小于1.5%,均在误差范围内,可见利用AVO反演能够比较准确的圈定瓦斯富集区。
文摘Electrolytes are widely considered as a key component in Li–O;batteries (LOBs) because they greatly affect the discharge-charge reaction kinetics and reversibility.Herein,we report that 1,3-dimethyl-2-imidazolidinone (DMI) is an excellent electrolyte solvent for LOBs.Comparing with conventional ether and sulfone based electrolytes,it has higher Li_(2)O_(2)and Li_(2)CO_(3)solubility,which on the one hand depresses cathode passivation during discharge,and on the other hand promotes the liquid-phase redox shuttling during charge,and consequently lowers the overpotential and improves the cyclability of the battery.However,despite the many advantages at the cathode side,DMI is not stable with bare Li anode.Thus,we have developed a pretreatment method to grow a protective artificial solid-state electrolyte interface(SEI) to prevent the unfavorable side-reactions on Li.The SEI film was formed via the reaction between fluorine-rich organic reagents and Li metal.It is composed of highly Li^(+)-conducting Li_(x)BO_(y),LiF,Li_(x)NO_(y),Li_(3)N particles and some organic compounds,in which Li_(x)BO_(y)serves as a binder to enhance its mechanical strength.With the protective SEI,the coulombic efficiency of Li plating/stripping in DMI electrolyte increased from 20%to 98.5%and the fixed capacity cycle life of the assembled LOB was elongated to205 rounds,which was almost fivefold of the cycle life in dimethyl sulfoxide (DMSO) or tetraglyme(TEGDME) based electrolytes.Our work demonstrates that molecular polarity and ionic solvation structure are the primary issues to be considered when designing high performance Li–O;battery electrolytes,and cross-linked artificial SEI is effective in improving the anodic stability.
基金the National Key R&D Program of China(2018YFA0305800)the Strategic Priority Research Program of Chinese Academy of Sciences(XDB28000000)+2 种基金the National Natural Science Foundation of China(11834014)Beijing Municipal Science and Technology Commission(Z191100007219013)University of Chinese Academy of Sciences。
文摘Ferroelectricity and metallicity are usually believed not to coexist because conducting electrons would screen out static internal electric fields.In 1965,Anderson and Blount proposed the concept of"ferroelectric metal",however,it is only until recently that very rare ferroelectric metals were reported.Here,by combining high-throughput ab initio calculations and data-driven machine learning method with new electronic orbital based descriptors,we systematically investigated a large family(2964)of two-dimensional(2D)bimetal phosphates,and discovered 60 stable ferroelectrics with out-of-plane polarization,including 16 ferroelectric metals and 44 ferroelectric semiconductors that contain seven multiferroics.The ferroelectricity origins from spontaneous symmetry breaking induced by the opposite displacements of bimetal atoms,and the full-d-orbital coinage metal elements cause larger displacements and polarization than other elements.For 2D ferroelectric metals,the odd electrons per unit cell without spin polarization may lead to a half-filled energy band around Fermi level and is responsible for the metallicity.It is revealed that the conducting electrons mainly move on a single-side surface of the 2D layer,while both the ionic and electric contributions to polarization come from the other side and are vertical to the above layer,thereby causing the coexistence of metallicity and ferroelectricity.Van der Waals heterostructures based on ferroelectric metals may enable the change of Schottky barrier height or the Schottky-Ohmic contact type and induce a dramatic change of their vertical transport properties.Our work greatly expands the family of 2D ferroelectric metals and will spur further exploration of 2D ferroelectric metals.
文摘We present a first-principles theoretical study of electric field- and straincontrolled intrinsic half-metallic properties of zigzagged aluminium nitride (A1N) nanoribbons. We show that the half-metallic property of AIN ribbons can undergo a transition into fully-metallic or semiconducting behavior with application of an electric field or uniaxial strain. An external transverse electric field induces a full charge screening that renders the material semiconducting. In contrast, as uniaxial strain varies from compressive to tensile, a spin-resolved selective self-doping increases the half-metallic character of the ribbons. The relevant strain-induced changes in electronic properties arise from band structure modifications at the Fermi level as a consequence of a spin-polarized charge transfer between p-orbitals of the N and A1 edge atoms in a spin-resolved self-doping process. This band structure tunability indicates the possibility of designing magnetic nanoribbons with tunable electronic structure by deriving edge states from elements with sufficiently different localization properties. Finite temperature molecular dynamics reveal a thermally stable half-metallic nanoribbon up to room temperature.
基金supported by the National Key R&D Program of China(2016YFB0100100)the National Natural Science Foundation of China(51702335 and 21773279)+8 种基金Zhejiang Non-profit Technology Applied Research Program(LGG19B010001)Ningbo Municipal Natural Science Foundation(2018A610084)the CAS-EU S&T Cooperation Partner Program(174433KYSB20150013)the Key Laboratory of Bio-based Polymeric Materials of Zhejiang Provincethe funding from Marie Sklodowska-Curie Fellowship in EUthe Engineering and Physical Sciences Research Council(EPSRC),including the SUPERGEN Energy Storage Hub(EP/L019469/1)Enabling Next Generation Lithium Batteries(EP/M009521/1)Henry Royce Institute for Advanced Materials(EP/R00661X/1,EP/S019367/1,EP/R010145/1)the Faraday Institution All-Solid-State Batteries with Li and Na Anodes(FIRG007,FIRG008)for financial support。
文摘Intercalation transition metal oxides (ITMO)have attracted great attention as lithium-ion battery negative electrodes due to high operation safety,high capacity and rapid ion intercalation.However,the intrinsic low electron conductivity plagues the lifetime and cell performance of the ITMO negative electrode.Here we design a new carbon-emcoating architecture through single CO_(2)activation treatment as demonstrated by the Nb_(2)O_(5)/C nanohybrid.Triple structure engineering of the carbon-emcoating Nb_(2)O_(5)/C nanohybrid is achieved in terms of porosity,composition,and crystallographic phase.The carbon-embedding Nb_(2)O_(5)/C nanohybrids show superior cycling and rate performance compared with the conventional carbon coating,with reversible capacity of 387 m A h g(-1)at 0.2 C and 92%of capacity retained after 500cycles at 1 C.Differential electrochemical mass spectrometry(DEMS) indicates that the carbon emcoated Nb_(2)O_(5)nanohybrids present less gas evolution than commercial lithium titanate oxide during cycling.The unique carbon-emcoating technique can be universally applied to other ITMO negative electrodes to achieve high electrochemical performance.