The examination of an unstructured finite volume method for structural dynamics is assessed for simulations of systematic impact dynamics. A robust display dual-time stepping method is utilized to obtain time accurate...The examination of an unstructured finite volume method for structural dynamics is assessed for simulations of systematic impact dynamics. A robust display dual-time stepping method is utilized to obtain time accurate solutions. The study of impact dynamics is a complex problem that should consider strength models and state equations to describe the mechanical behavior of materials. The current method has several features, l) Discrete equations of unstructured finite volume method naturally follow the conservation law. 2) Display dual-time stepping method is suitable for the analysis of impact dynamic problems of time accurate solutions. 3) The method did not produce grid distortion when large deformation appeared. The method is validated by the problem of impact dynamics of an elastic plate with initial conditions and material properties. The results validate the finite element numerical data展开更多
At present,there is not much research on mid-story isolated structures in mountainous areas.In this study,a model of a mid-story isolated structure considering soil-structure interaction(SSI)in mountainous areas is es...At present,there is not much research on mid-story isolated structures in mountainous areas.In this study,a model of a mid-story isolated structure considering soil-structure interaction(SSI)in mountainous areas is established along with a model that does not consider SSI.Eight long-period earthquake waves and two ordinary earthquake waves are selected as inputs for the dynamic time history analysis of the structure.The results show that the seismic response of a mid-story isolated structure considering SSI in mountainous areas can be amplified when compared with a structure that does not consider SSI.The structure response under long-period earthquakes is larger than that of ordinary earthquakes.The structure response under far-field harmonic-like earthquakes is larger than that of near-fault pulse-type earthquakes.The structure response under near-fault pulse-type earthquakes is larger than that of far-field non-harmonic earthquakes.When subjected to long-period earthquakes,the displacement of the isolated bearings exceeded the limit value,which led to instability and overturning of the structure.The structure with dampers in the isolated story could adequately control the nonlinear response of the structure,effectively reduce the displacement of the isolated bearings,and provide a convenient,efficient and economic method not only for new construction but also to retrofit existing structures.展开更多
In order to simulate and analyze the dynamic characteristics of the parachute from advanced tactical parachute system(ATPS),a nonlinear finite element algorithm and a preconditioning finite volume method are employed ...In order to simulate and analyze the dynamic characteristics of the parachute from advanced tactical parachute system(ATPS),a nonlinear finite element algorithm and a preconditioning finite volume method are employed and developed to construct three dimensional parachute fluid-structure interaction(FSI)model.Parachute fabric material is represented by membrane-cable elements,and geometrical nonlinear algorithm is employed with wrinkling technique embedded to simulate the large deformations of parachute structure by applying the NewtonRaphson iteration method.On the other hand,the time-dependent flow surrounding parachute canopy is simulated using preconditioned lower-upper symmetric Gauss-Seidel(LU-SGS)method.The pseudo solid dynamic mesh algorithm is employed to update the flow-field mesh based on the complex and arbitrary motion of parachute canopy.Due to the large amount of computation during the FSI simulation,massage passing interface(MPI)parallel computation technique is used for all those three modules to improve the performance of the FSI code.The FSI method is tested to simulate one kind of ATPS parachutes to predict the parachute configuration and anticipate the parachute descent speeds.The comparison of results between the proposed method and those in literatures demonstrates the method to be a useful tool for parachute designers.展开更多
For general volatility structures for forward rates, the evolution of interest rates may not be Markovian and the entire path may be necessary to capture the dynamics of the term structure. This article identifies con...For general volatility structures for forward rates, the evolution of interest rates may not be Markovian and the entire path may be necessary to capture the dynamics of the term structure. This article identifies conditions on the volatility structure of forward rates that permit the dynamics of the term structure to be represented by a finite-dimensional state variable Markov process. In the deterministic volatility case, we interpret then-factor model as a sum ofn unidimensional models.展开更多
The structure–dynamics correlations in a nonlocal manner were investigated in CuZr metallic glass-forming liquids via classical molecular dynamics simulations.A spatial coarse-graining approach was employed to incorp...The structure–dynamics correlations in a nonlocal manner were investigated in CuZr metallic glass-forming liquids via classical molecular dynamics simulations.A spatial coarse-graining approach was employed to incorporate the nonlocal structural information of given structural order parameters in the structure–dynamics relationship.It is found that the correlation between structure order parameters and dynamics increases with increasing coarse-graining length and has a characteristic length scale.Moreover,the characteristic correlation length exhibits a non-monotonic temperature evolution as temperature approaches glass transition temperature,which is not sensitive to the considered structure order parameters.Our results unveil a striking change in the structure–dynamics correlation,which involves no fitting theoretical interpretation.These findings provide new insight into the structure–dynamics correlation in glass transition.展开更多
The microstructure, IR spectrum, as well as rotation dynamics of water molecule in sodium tetrafluoroborate (NaBF4)/water mixture at room temperatures were studied with molecular dynamics simulation. Different conce...The microstructure, IR spectrum, as well as rotation dynamics of water molecule in sodium tetrafluoroborate (NaBF4)/water mixture at room temperatures were studied with molecular dynamics simulation. Different concentrations of water (6.25%, 25.0%, 50.0%, 75.0%, 90.0%, and 99.6%) in NaBF4/water mixture were simulated to understand the structure and dynamics. It was shown that water molecules tend to be isolated from each other in mixtures with more ions than water molecules in both liquids. With increase of the molar fraction of water in the mixture, the rotation bands and the bending bands of water display red shift whereas the O-H stretch bands show blue shift, and the decay of the reorientation correlation function becomes slower. This suggests that the molecules are hindered and their motions are difficult and slow, due to the hydrogen-bond interactions and the inharmonic interactions between the interor intra-molecular modes.展开更多
We give a brief review of the asymptotic theory of slender vortex filaments with emphases on (i) the choices of scalings and small parameters characterizing the physical problem,(ii) the key steps in the formulation o...We give a brief review of the asymptotic theory of slender vortex filaments with emphases on (i) the choices of scalings and small parameters characterizing the physical problem,(ii) the key steps in the formulation of the theory and (iii) the assumptions and/or restrictions on the theory of Callegari and Ting (1978).We present highlights of an extension of the 1978 asymptotic theory:the analyses for core structures with axial variation.Making use of the physical insights gained from the analyses,we present a new derivation of the evolution equations for the core structure.The new one is simpler and straightforward and shows the physics clearly.展开更多
Deep neural network-based relational extraction research has made significant progress in recent years,andit provides data support for many natural language processing downstream tasks such as building knowledgegraph,...Deep neural network-based relational extraction research has made significant progress in recent years,andit provides data support for many natural language processing downstream tasks such as building knowledgegraph,sentiment analysis and question-answering systems.However,previous studies ignored much unusedstructural information in sentences that could enhance the performance of the relation extraction task.Moreover,most existing dependency-based models utilize self-attention to distinguish the importance of context,whichhardly deals withmultiple-structure information.To efficiently leverage multiple structure information,this paperproposes a dynamic structure attention mechanism model based on textual structure information,which deeplyintegrates word embedding,named entity recognition labels,part of speech,dependency tree and dependency typeinto a graph convolutional network.Specifically,our model extracts text features of different structures from theinput sentence.Textual Structure information Graph Convolutional Networks employs the dynamic structureattention mechanism to learn multi-structure attention,effectively distinguishing important contextual features invarious structural information.In addition,multi-structure weights are carefully designed as amergingmechanismin the different structure attention to dynamically adjust the final attention.This paper combines these featuresand trains a graph convolutional network for relation extraction.We experiment on supervised relation extractiondatasets including SemEval 2010 Task 8,TACRED,TACREV,and Re-TACED,the result significantly outperformsthe previous.展开更多
Dynamic structuralcolors can change in response todifferent environmental stimuli.This ability remains effectiveeven when the size of the speciesresponsible for the structural coloris reduced to a few micrometers,prov...Dynamic structuralcolors can change in response todifferent environmental stimuli.This ability remains effectiveeven when the size of the speciesresponsible for the structural coloris reduced to a few micrometers,providing a promising sensingmechanism for solving microenvironmentalsensing problems inmicro-robotics and microfluidics.However, the lack of dynamicstructural colors that can encoderapidly, easily integrate, and accuratelyreflect changes in physical quantities hinders their use in microscale sensing applications. Herein, we present a 2.5-dimensionaldynamic structural color based on nanogratings of heterogeneous materials, which were obtained by interweaving a pH-responsive hydrogelwith an IP-L photoresist. Transverse gratings printed with pH-responsive hydrogels elongated the period of longitudinal grating in the swollenstate, resulting in pH-tuned structural colors at a 45° incidence. Moreover, the patterned encoding and array printing of dynamic structuralcolors were achieved using grayscale stripe images to accurately encode the periods and heights of the nanogrid structures. Overall, dynamicstructural color networks exhibit promising potential for applications in information encryption and in situ sensing for microfluidic chips.展开更多
This paper presents a framework for constructing surrogate models for sensitivity analysis of structural dynamics behavior.Physical models involving deformation,such as collisions,vibrations,and penetration,are devel-...This paper presents a framework for constructing surrogate models for sensitivity analysis of structural dynamics behavior.Physical models involving deformation,such as collisions,vibrations,and penetration,are devel-oped using the material point method.To reduce the computational cost of Monte Carlo simulations,response surface models are created as surrogate models for the material point system to approximate its dynamic behavior.An adaptive randomized greedy algorithm is employed to construct a sparse polynomial chaos expansion model with a fixed order,effectively balancing the accuracy and computational efficiency of the surrogate model.Based on the sparse polynomial chaos expansion,sensitivity analysis is conducted using the global finite difference and Sobol methods.Several examples of structural dynamics are provided to demonstrate the effectiveness of the proposed method in addressing structural dynamics problems.展开更多
An extremely dense radiation fog event during 10-11 December 2007 was studied to understand its macro-micro-physics in relation to dynamic and thermodynamic structures of the boundary layer, as well as its structural ...An extremely dense radiation fog event during 10-11 December 2007 was studied to understand its macro-micro-physics in relation to dynamic and thermodynamic structures of the boundary layer, as well as its structural evolution in conjunction with the air-surface exchange of heat and water vapor. The findings are as follows. The extreme radiation fog process was divisible into formation, development, mature, and dissipation phases, depending on microstructure and visibility. This fog event was marked by rapid evolution that occurred after sunrise, when enhanced surface evaporation and cold air intrusion led to a three order of magnitude increase in liquid water content (LWC) in just 20 minutes. The maximum droplet diameter (MDD) increased four-fold during the same period. The fog structure was two-layered, with the top of both the surface-layer and upper-layer components characterized by strong temperature and humidity inversions, and low-level jets existed in the boundary layer above each fog layer. Turbulence intensity, turbulent kinetic energy, and friction velocity differed remarkably from phase to phase: these features increased gradually before the fog formation and decreased during the development phase; during the mature and dissipation phases these characteristics increased and then decreased again. In the development and mature stages, the mean kinetic energy of the lower-level winds decreased pronouncedly, both in the horizontal and vertical directions.展开更多
The decay dynamics of N, N-dimethylthioacetamide after excitation to the S3(ππ*) state was studied by using the resonance Raman spectroscopy and complete active space self- consistent field method calculations. T...The decay dynamics of N, N-dimethylthioacetamide after excitation to the S3(ππ*) state was studied by using the resonance Raman spectroscopy and complete active space self- consistent field method calculations. The UV-absorption and vibrational spectra were as- signed. The A-band resonance Raman spectra were obtained in acetonitrile, methanol and water with the laser excitation wavelengths in resonance with the first intense absorption band to probe the Franck-Condon region structural dynamics. The CASSCF calculations were carried out to determine the excitation energies and optimized structures of the lower- lying singlet states and conical intersection point. The A-band structural dynamics and the corresponding decay mechanism were obtained by the analysis of the resonance Raman in- tensity pattern and the CASSCF calculated structural parameters. The major decay channel of S3,FC (ππ*)→S3(ππ*)/S1 (nπ*)→S1(nπ*) is proposed.展开更多
The photophysics of 3-dimethylamino-2-methyl-propenal (DMAMP) after excitation to the S2 (ππ^*) electronic state was studied using the resonance Raman spectroscopy and complete active space self-consistent fiel...The photophysics of 3-dimethylamino-2-methyl-propenal (DMAMP) after excitation to the S2 (ππ^*) electronic state was studied using the resonance Raman spectroscopy and complete active space self-consistent field method calculations. The transition barriers of the ground state tautomerization reactions between DMAMP and its three isomers were determined at B3LYP/6-311++G(d,p) level of theory. The vibrational spectra were assigned. The A- band resonance Raman spectra were obtained in acetonitrile with excitation wavelengths in resonance with the first intense absorption band to probe the structural dynamics of DMAMP. The B3LYP-TD computation was carried out to determine the relative A-band resonance Raman intensities of the fundamental modes, and the result indicated that the vibronic-coupling existed in Franck-Condon region. Complete active space self-consistent field (CASSCF) calculations were carried out to determine the excitation energies of the lower-lying singlet and triplet excited states, the conical intersection points and the intersystem crossing points. The A-band short-time structural dynamics and the corresponding decay dynamics of DMAMP were obtained by analysis of the resonance Raman intensity pattern and CASSCF computations. It was found that a sudden de-conjugation between C1=O6 and C2=C3 occurred at the Franck-Condon region of the S2(ππ^*) state, while the enhancement of the conjugation interaction between C3 and N(CH3)2, and between C1 and C2 evolutions shortly after the wavepacket leaves away the Pranck-Condon region via the excited state charge redistribution. The de-conjugation interaction between C1=O6 and C2=C3 made the rotation of C3=N(CH3)2 group around the C2-C3 bond much easier, while the enhanced conjugation between C1 and C2, and between C3 and N(CH3)2 made the rotation around the C1-C2 bond and C3-N5 more difficult. It was revealed that the initial structural dynamics of DMAMP was predominantly towards the CI-I(S2/S0) point, while the opportunities towards either CI-2(S2/S0) or CI-3(S2/S0) point were negligible. Two decay channels of DMAMP from S2,FC(ππ^*) to So or Tl,min via various CIs and ISCs were proposed.展开更多
Typhoon Rananim (2004) was one of the severest typhoons landfalling the Chinese mainland from 1996 to 2004. It brought serious damage and induced prodigious economical loss. Using a new generation of mesoscale model...Typhoon Rananim (2004) was one of the severest typhoons landfalling the Chinese mainland from 1996 to 2004. It brought serious damage and induced prodigious economical loss. Using a new generation of mesoscale model, named the Weather Research and Forecasting (WRF) modeling system, with 1.667 km grid horizontal spacing on the finest nested mesh, Rananim was successfully simulated in terms of track, intensity, eye, eyewall, and spiral rainbands. We compared the structures of Rananim to those of hurricanes in previous studies and observations to assess the validity of simulation. The three-dimensional (3D) dynamic and thermal structures of eye and eyewall were studied based on the simulated results. The focus was investigation of the characteristics of the vortex Rossby waves in the inner-core region. We found that the Rossby vortex waves propagate azimuthally upwind against the azimuthal mean tangential flow around the eyewall, and their period was longer than that of an air parcel moving within the azimuthal mean tangential flow. They also propagated outward against the boundary layer inflow of the azimuthal mean vortex. Puthermore, we studied the connection between the spiral potential vorticity (PV) bands and spiral rainbands, and found that the vortex Rossby waves played an important role in the formation process of spiral rainbands.展开更多
An optimization method for the consistent evaluation of two Rayleigh damping coefficients is proposed. By minimizing an objective function such as an error term of the peak displacement of a structure, the two coeffic...An optimization method for the consistent evaluation of two Rayleigh damping coefficients is proposed. By minimizing an objective function such as an error term of the peak displacement of a structure, the two coefficients can be determined with response spectral analysis. The optimization method degenerates into the conventional method used in current practices when only two modes of vibration are included in the objective function. Therefore, the proposed method with all significant modes included for simplicity in practical applications results in suboptimal damping coefficients. The effects of both spatial distribution and frequency content of excitations as well as structural dynamic characteristics on the evaluation of Rayleigh damping coefficients were investigated with a five-story building structure. Two application examples with a 62-story high-rise building and a 840 m long cable-stayed bridge under ten earthquake excitations demonstrated the accuracy and effectiveness of the proposed method to account for all of the above effects.展开更多
Wall-bounded turbulent flow involves the development of multi-scale turbulent eddies, as well as a sharply varying boundary layer. Its theoretical descriptions are yet phenomenological. We present here a new framework...Wall-bounded turbulent flow involves the development of multi-scale turbulent eddies, as well as a sharply varying boundary layer. Its theoretical descriptions are yet phenomenological. We present here a new framework called structural ensemble dynamics (SED), which aims at using systematically all relevant statistical properties of turbulent structures for a quantitative description of ensemble means. A new set of closure equations based on the SED approach for a turbulent channel flow is presented. SED order functions are defined, and numerically determined from data of direct numerical simulations (DNS). Computational results show that the new closure model reproduces accurately the solution of the original Navier-Stokes simulation, including the mean velocity profile, the kinetic energy of the streamwise velocity component, and every term in the energy budget equation. It is suggested that the SED-based studies of turbulent structure builds a bridge between the studies of physical mechanisms of turbulence and the development of accurate model equations for engineering predictions.展开更多
An investigation of soil-pile-structure interaction is carried out, based on a large reciprocating compressor installed on an elevated concrete foundation (table top structure). A practical method is described for t...An investigation of soil-pile-structure interaction is carried out, based on a large reciprocating compressor installed on an elevated concrete foundation (table top structure). A practical method is described for the dynamic analysis, and compared with a 3D finite element (FE) model. Two commercial software packages are used for dynamic analysis considering the soilpile-structure interaction (SPSI). Stiffness and damping of the pile foundation are generated from a computer program, and then input into the FE model. To examine the SPSI thoroughly, three cases for the soil, piles and superstructure are considered and compared. In the first case, the interaction is fully taken into account, that is, both the superstructure and soil-pile system are flexible. In the second case, the superstructure is flexible but fixed to a rigid base, with no deformation in the base (no SSI). In the third case, the dynamic soil-pile interaction is taken into account, but the table top structure is assumed to be rigid. From the comparison beteen the results of these three cases some conclusions are made, which could be helpful for engineering practice.展开更多
The seismic behavior of tall buildings can he greatly affected by non-linear soil-pile interaction during strong earthquakes.In this study a 20-storey building is examined as a typical structure supported on a pile fo...The seismic behavior of tall buildings can he greatly affected by non-linear soil-pile interaction during strong earthquakes.In this study a 20-storey building is examined as a typical structure supported on a pile foundation for different conditions:(1) rigid base,i.e.no deformation in the foundation:(2) linear soil-pile system;and (3) nonlinear soil-pile system. The effects of pile foundation displacements on the behavior of tall building are investigated,and compared with the behavior of buildings supported on shallow foundation.With a model of non-reflective boundary between the near field and far field, Novak's method of soil-pile interaction is improved.The computation method for vibration of pile foundations and DYNAN computer program are introduced comprehensively.A series of dynamic experiments have been done on full-scale piles, including single pile and group,linear vibration and nonlinear vibration,to verify the validity of boundary zone model.展开更多
The excited state structural dynamics of phenyl absorbing S2(A'), S3(A'), and S6(A') states were troseopy and complete active space self-consistent and the UV absorption bands were assigned on azide (PhN3) ...The excited state structural dynamics of phenyl absorbing S2(A'), S3(A'), and S6(A') states were troseopy and complete active space self-consistent and the UV absorption bands were assigned on azide (PhN3) after excitation to the light studied using the resonance Raman specfield calculations. The vibrational spectra the basis of the Fourier transform (FT)- Raman, FT-infrared measurements, the density-functional theory computations and the normal mode analysis. The A-, B-, and C-bands resonance Raman spectra in cyclohex- ane, acetonitrile, and methanol solvents were, respectively, obtained at 273.9, 252.7, 245.9, 228.7, 223.1, and 208.8 nm excitation wavelengths to probe the corresponding structural dynamics of PhN3. The results indicated that the structural dynamics in the S2 (A'), S3(A'), and S6(A') states were significantly different. The crossing points of the potential energy surfaces, S2S1(1) and S2S1(2), were predicted to play a key role in the low-lying excited state decay dynamics, in accordance with Kasha's rule, and NT=N8 dissociation. Two decay channels initiated from the Franck-Condon region of the S2(A') state were predicted: the radiative S2,min→S0 radiative decay and the S2→S1 internal conversion through the crossing points S2S1 (1)/S2S1(2).展开更多
文摘The examination of an unstructured finite volume method for structural dynamics is assessed for simulations of systematic impact dynamics. A robust display dual-time stepping method is utilized to obtain time accurate solutions. The study of impact dynamics is a complex problem that should consider strength models and state equations to describe the mechanical behavior of materials. The current method has several features, l) Discrete equations of unstructured finite volume method naturally follow the conservation law. 2) Display dual-time stepping method is suitable for the analysis of impact dynamic problems of time accurate solutions. 3) The method did not produce grid distortion when large deformation appeared. The method is validated by the problem of impact dynamics of an elastic plate with initial conditions and material properties. The results validate the finite element numerical data
基金National Natural Science Fund of China under Nos.52168072 and 51808467High-level Talents Support Plan of Yunnan Province of China(2020)。
文摘At present,there is not much research on mid-story isolated structures in mountainous areas.In this study,a model of a mid-story isolated structure considering soil-structure interaction(SSI)in mountainous areas is established along with a model that does not consider SSI.Eight long-period earthquake waves and two ordinary earthquake waves are selected as inputs for the dynamic time history analysis of the structure.The results show that the seismic response of a mid-story isolated structure considering SSI in mountainous areas can be amplified when compared with a structure that does not consider SSI.The structure response under long-period earthquakes is larger than that of ordinary earthquakes.The structure response under far-field harmonic-like earthquakes is larger than that of near-fault pulse-type earthquakes.The structure response under near-fault pulse-type earthquakes is larger than that of far-field non-harmonic earthquakes.When subjected to long-period earthquakes,the displacement of the isolated bearings exceeded the limit value,which led to instability and overturning of the structure.The structure with dampers in the isolated story could adequately control the nonlinear response of the structure,effectively reduce the displacement of the isolated bearings,and provide a convenient,efficient and economic method not only for new construction but also to retrofit existing structures.
文摘In order to simulate and analyze the dynamic characteristics of the parachute from advanced tactical parachute system(ATPS),a nonlinear finite element algorithm and a preconditioning finite volume method are employed and developed to construct three dimensional parachute fluid-structure interaction(FSI)model.Parachute fabric material is represented by membrane-cable elements,and geometrical nonlinear algorithm is employed with wrinkling technique embedded to simulate the large deformations of parachute structure by applying the NewtonRaphson iteration method.On the other hand,the time-dependent flow surrounding parachute canopy is simulated using preconditioned lower-upper symmetric Gauss-Seidel(LU-SGS)method.The pseudo solid dynamic mesh algorithm is employed to update the flow-field mesh based on the complex and arbitrary motion of parachute canopy.Due to the large amount of computation during the FSI simulation,massage passing interface(MPI)parallel computation technique is used for all those three modules to improve the performance of the FSI code.The FSI method is tested to simulate one kind of ATPS parachutes to predict the parachute configuration and anticipate the parachute descent speeds.The comparison of results between the proposed method and those in literatures demonstrates the method to be a useful tool for parachute designers.
文摘For general volatility structures for forward rates, the evolution of interest rates may not be Markovian and the entire path may be necessary to capture the dynamics of the term structure. This article identifies conditions on the volatility structure of forward rates that permit the dynamics of the term structure to be represented by a finite-dimensional state variable Markov process. In the deterministic volatility case, we interpret then-factor model as a sum ofn unidimensional models.
基金the National Natural Science Foundation of China(Grant Nos.52031016 and 51631003)。
文摘The structure–dynamics correlations in a nonlocal manner were investigated in CuZr metallic glass-forming liquids via classical molecular dynamics simulations.A spatial coarse-graining approach was employed to incorporate the nonlocal structural information of given structural order parameters in the structure–dynamics relationship.It is found that the correlation between structure order parameters and dynamics increases with increasing coarse-graining length and has a characteristic length scale.Moreover,the characteristic correlation length exhibits a non-monotonic temperature evolution as temperature approaches glass transition temperature,which is not sensitive to the considered structure order parameters.Our results unveil a striking change in the structure–dynamics correlation,which involves no fitting theoretical interpretation.These findings provide new insight into the structure–dynamics correlation in glass transition.
基金The authors are grateful to Professor Jiu-shu Shao at Beijing Normal University for his encourage and help reading the manuscript. We also would like to thank Prof. Jian-min Tao and Guo-bao Li for their kind help. This work was supported by the National Natural Science Foundation of China (No.50564006), the Key program of Natural Science Foundation of Yunnan Provine (No.2005EOOO4Z), the Natural Science Foundation of Yunnan Provine (No.2008E0049M), the Foundation of the Education Department of Yunnan Province (No.07Z40082), and the Foundation of Kunming University of Science and Technology (No.2007-16).
文摘The microstructure, IR spectrum, as well as rotation dynamics of water molecule in sodium tetrafluoroborate (NaBF4)/water mixture at room temperatures were studied with molecular dynamics simulation. Different concentrations of water (6.25%, 25.0%, 50.0%, 75.0%, 90.0%, and 99.6%) in NaBF4/water mixture were simulated to understand the structure and dynamics. It was shown that water molecules tend to be isolated from each other in mixtures with more ions than water molecules in both liquids. With increase of the molar fraction of water in the mixture, the rotation bands and the bending bands of water display red shift whereas the O-H stretch bands show blue shift, and the decay of the reorientation correlation function becomes slower. This suggests that the molecules are hindered and their motions are difficult and slow, due to the hydrogen-bond interactions and the inharmonic interactions between the interor intra-molecular modes.
文摘We give a brief review of the asymptotic theory of slender vortex filaments with emphases on (i) the choices of scalings and small parameters characterizing the physical problem,(ii) the key steps in the formulation of the theory and (iii) the assumptions and/or restrictions on the theory of Callegari and Ting (1978).We present highlights of an extension of the 1978 asymptotic theory:the analyses for core structures with axial variation.Making use of the physical insights gained from the analyses,we present a new derivation of the evolution equations for the core structure.The new one is simpler and straightforward and shows the physics clearly.
文摘Deep neural network-based relational extraction research has made significant progress in recent years,andit provides data support for many natural language processing downstream tasks such as building knowledgegraph,sentiment analysis and question-answering systems.However,previous studies ignored much unusedstructural information in sentences that could enhance the performance of the relation extraction task.Moreover,most existing dependency-based models utilize self-attention to distinguish the importance of context,whichhardly deals withmultiple-structure information.To efficiently leverage multiple structure information,this paperproposes a dynamic structure attention mechanism model based on textual structure information,which deeplyintegrates word embedding,named entity recognition labels,part of speech,dependency tree and dependency typeinto a graph convolutional network.Specifically,our model extracts text features of different structures from theinput sentence.Textual Structure information Graph Convolutional Networks employs the dynamic structureattention mechanism to learn multi-structure attention,effectively distinguishing important contextual features invarious structural information.In addition,multi-structure weights are carefully designed as amergingmechanismin the different structure attention to dynamically adjust the final attention.This paper combines these featuresand trains a graph convolutional network for relation extraction.We experiment on supervised relation extractiondatasets including SemEval 2010 Task 8,TACRED,TACREV,and Re-TACED,the result significantly outperformsthe previous.
基金supported by the National Natural Science Foundation of China(Grant No.61925307).
文摘Dynamic structuralcolors can change in response todifferent environmental stimuli.This ability remains effectiveeven when the size of the speciesresponsible for the structural coloris reduced to a few micrometers,providing a promising sensingmechanism for solving microenvironmentalsensing problems inmicro-robotics and microfluidics.However, the lack of dynamicstructural colors that can encoderapidly, easily integrate, and accuratelyreflect changes in physical quantities hinders their use in microscale sensing applications. Herein, we present a 2.5-dimensionaldynamic structural color based on nanogratings of heterogeneous materials, which were obtained by interweaving a pH-responsive hydrogelwith an IP-L photoresist. Transverse gratings printed with pH-responsive hydrogels elongated the period of longitudinal grating in the swollenstate, resulting in pH-tuned structural colors at a 45° incidence. Moreover, the patterned encoding and array printing of dynamic structuralcolors were achieved using grayscale stripe images to accurately encode the periods and heights of the nanogrid structures. Overall, dynamicstructural color networks exhibit promising potential for applications in information encryption and in situ sensing for microfluidic chips.
基金support from the National Natural Science Foundation of China(Grant Nos.52174123&52274222).
文摘This paper presents a framework for constructing surrogate models for sensitivity analysis of structural dynamics behavior.Physical models involving deformation,such as collisions,vibrations,and penetration,are devel-oped using the material point method.To reduce the computational cost of Monte Carlo simulations,response surface models are created as surrogate models for the material point system to approximate its dynamic behavior.An adaptive randomized greedy algorithm is employed to construct a sparse polynomial chaos expansion model with a fixed order,effectively balancing the accuracy and computational efficiency of the surrogate model.Based on the sparse polynomial chaos expansion,sensitivity analysis is conducted using the global finite difference and Sobol methods.Several examples of structural dynamics are provided to demonstrate the effectiveness of the proposed method in addressing structural dynamics problems.
基金supported jointly by the Key Project of Natural Science Foundation of Jiangsu Province under Grant No BK2007727the Scientific Project for Public Welfare specific to Meteo rologists (GYHY200706026, GYHY200906012)+1 种基金Qinglan Project "cloud fog precipitation and aerosol research innovation group"the National Natural Science Foundation of China (Grant Nos 40775012, 40975085, and 40775010)
文摘An extremely dense radiation fog event during 10-11 December 2007 was studied to understand its macro-micro-physics in relation to dynamic and thermodynamic structures of the boundary layer, as well as its structural evolution in conjunction with the air-surface exchange of heat and water vapor. The findings are as follows. The extreme radiation fog process was divisible into formation, development, mature, and dissipation phases, depending on microstructure and visibility. This fog event was marked by rapid evolution that occurred after sunrise, when enhanced surface evaporation and cold air intrusion led to a three order of magnitude increase in liquid water content (LWC) in just 20 minutes. The maximum droplet diameter (MDD) increased four-fold during the same period. The fog structure was two-layered, with the top of both the surface-layer and upper-layer components characterized by strong temperature and humidity inversions, and low-level jets existed in the boundary layer above each fog layer. Turbulence intensity, turbulent kinetic energy, and friction velocity differed remarkably from phase to phase: these features increased gradually before the fog formation and decreased during the development phase; during the mature and dissipation phases these characteristics increased and then decreased again. In the development and mature stages, the mean kinetic energy of the lower-level winds decreased pronouncedly, both in the horizontal and vertical directions.
基金This work was supported by the National Natu- ral Science Foundation of China (No.21033002 and No.21202032) and the National Basic Research Pro- gram of China (No.2013CB834604).
文摘The decay dynamics of N, N-dimethylthioacetamide after excitation to the S3(ππ*) state was studied by using the resonance Raman spectroscopy and complete active space self- consistent field method calculations. The UV-absorption and vibrational spectra were as- signed. The A-band resonance Raman spectra were obtained in acetonitrile, methanol and water with the laser excitation wavelengths in resonance with the first intense absorption band to probe the Franck-Condon region structural dynamics. The CASSCF calculations were carried out to determine the excitation energies and optimized structures of the lower- lying singlet states and conical intersection point. The A-band structural dynamics and the corresponding decay mechanism were obtained by the analysis of the resonance Raman in- tensity pattern and the CASSCF calculated structural parameters. The major decay channel of S3,FC (ππ*)→S3(ππ*)/S1 (nπ*)→S1(nπ*) is proposed.
基金ACKNOWLEDGMENTS This work was supported by the National Natural Science Foundation of China (No.21033002 and No.21202032) and the National Basic Research Program of China (No.2013CB834604).
文摘The photophysics of 3-dimethylamino-2-methyl-propenal (DMAMP) after excitation to the S2 (ππ^*) electronic state was studied using the resonance Raman spectroscopy and complete active space self-consistent field method calculations. The transition barriers of the ground state tautomerization reactions between DMAMP and its three isomers were determined at B3LYP/6-311++G(d,p) level of theory. The vibrational spectra were assigned. The A- band resonance Raman spectra were obtained in acetonitrile with excitation wavelengths in resonance with the first intense absorption band to probe the structural dynamics of DMAMP. The B3LYP-TD computation was carried out to determine the relative A-band resonance Raman intensities of the fundamental modes, and the result indicated that the vibronic-coupling existed in Franck-Condon region. Complete active space self-consistent field (CASSCF) calculations were carried out to determine the excitation energies of the lower-lying singlet and triplet excited states, the conical intersection points and the intersystem crossing points. The A-band short-time structural dynamics and the corresponding decay dynamics of DMAMP were obtained by analysis of the resonance Raman intensity pattern and CASSCF computations. It was found that a sudden de-conjugation between C1=O6 and C2=C3 occurred at the Franck-Condon region of the S2(ππ^*) state, while the enhancement of the conjugation interaction between C3 and N(CH3)2, and between C1 and C2 evolutions shortly after the wavepacket leaves away the Pranck-Condon region via the excited state charge redistribution. The de-conjugation interaction between C1=O6 and C2=C3 made the rotation of C3=N(CH3)2 group around the C2-C3 bond much easier, while the enhanced conjugation between C1 and C2, and between C3 and N(CH3)2 made the rotation around the C1-C2 bond and C3-N5 more difficult. It was revealed that the initial structural dynamics of DMAMP was predominantly towards the CI-I(S2/S0) point, while the opportunities towards either CI-2(S2/S0) or CI-3(S2/S0) point were negligible. Two decay channels of DMAMP from S2,FC(ππ^*) to So or Tl,min via various CIs and ISCs were proposed.
基金supported by the National Key Basic Research and Development Project of China (Grant Nos. 2004CB418301,2009CB421503)National Natural Science Foundation of China (Grant No. 40775033)the Chinese Special Scientific Research Project for Public Interest (Grant No.GYHY200806009)
文摘Typhoon Rananim (2004) was one of the severest typhoons landfalling the Chinese mainland from 1996 to 2004. It brought serious damage and induced prodigious economical loss. Using a new generation of mesoscale model, named the Weather Research and Forecasting (WRF) modeling system, with 1.667 km grid horizontal spacing on the finest nested mesh, Rananim was successfully simulated in terms of track, intensity, eye, eyewall, and spiral rainbands. We compared the structures of Rananim to those of hurricanes in previous studies and observations to assess the validity of simulation. The three-dimensional (3D) dynamic and thermal structures of eye and eyewall were studied based on the simulated results. The focus was investigation of the characteristics of the vortex Rossby waves in the inner-core region. We found that the Rossby vortex waves propagate azimuthally upwind against the azimuthal mean tangential flow around the eyewall, and their period was longer than that of an air parcel moving within the azimuthal mean tangential flow. They also propagated outward against the boundary layer inflow of the azimuthal mean vortex. Puthermore, we studied the connection between the spiral potential vorticity (PV) bands and spiral rainbands, and found that the vortex Rossby waves played an important role in the formation process of spiral rainbands.
基金National Natural Science Foundation of China under Grant No.51078032the Visiting Scholar Foundation of China Scholarship Councilthe Center for Infrastructure Engineering Studies at Missouri University of Science and Technology
文摘An optimization method for the consistent evaluation of two Rayleigh damping coefficients is proposed. By minimizing an objective function such as an error term of the peak displacement of a structure, the two coefficients can be determined with response spectral analysis. The optimization method degenerates into the conventional method used in current practices when only two modes of vibration are included in the objective function. Therefore, the proposed method with all significant modes included for simplicity in practical applications results in suboptimal damping coefficients. The effects of both spatial distribution and frequency content of excitations as well as structural dynamic characteristics on the evaluation of Rayleigh damping coefficients were investigated with a five-story building structure. Two application examples with a 62-story high-rise building and a 840 m long cable-stayed bridge under ten earthquake excitations demonstrated the accuracy and effectiveness of the proposed method to account for all of the above effects.
基金supported by the National Natural Science Foundation of China (90716008)the MOST under 973 project (2009CB724100)
文摘Wall-bounded turbulent flow involves the development of multi-scale turbulent eddies, as well as a sharply varying boundary layer. Its theoretical descriptions are yet phenomenological. We present here a new framework called structural ensemble dynamics (SED), which aims at using systematically all relevant statistical properties of turbulent structures for a quantitative description of ensemble means. A new set of closure equations based on the SED approach for a turbulent channel flow is presented. SED order functions are defined, and numerically determined from data of direct numerical simulations (DNS). Computational results show that the new closure model reproduces accurately the solution of the original Navier-Stokes simulation, including the mean velocity profile, the kinetic energy of the streamwise velocity component, and every term in the energy budget equation. It is suggested that the SED-based studies of turbulent structure builds a bridge between the studies of physical mechanisms of turbulence and the development of accurate model equations for engineering predictions.
文摘An investigation of soil-pile-structure interaction is carried out, based on a large reciprocating compressor installed on an elevated concrete foundation (table top structure). A practical method is described for the dynamic analysis, and compared with a 3D finite element (FE) model. Two commercial software packages are used for dynamic analysis considering the soilpile-structure interaction (SPSI). Stiffness and damping of the pile foundation are generated from a computer program, and then input into the FE model. To examine the SPSI thoroughly, three cases for the soil, piles and superstructure are considered and compared. In the first case, the interaction is fully taken into account, that is, both the superstructure and soil-pile system are flexible. In the second case, the superstructure is flexible but fixed to a rigid base, with no deformation in the base (no SSI). In the third case, the dynamic soil-pile interaction is taken into account, but the table top structure is assumed to be rigid. From the comparison beteen the results of these three cases some conclusions are made, which could be helpful for engineering practice.
文摘The seismic behavior of tall buildings can he greatly affected by non-linear soil-pile interaction during strong earthquakes.In this study a 20-storey building is examined as a typical structure supported on a pile foundation for different conditions:(1) rigid base,i.e.no deformation in the foundation:(2) linear soil-pile system;and (3) nonlinear soil-pile system. The effects of pile foundation displacements on the behavior of tall building are investigated,and compared with the behavior of buildings supported on shallow foundation.With a model of non-reflective boundary between the near field and far field, Novak's method of soil-pile interaction is improved.The computation method for vibration of pile foundations and DYNAN computer program are introduced comprehensively.A series of dynamic experiments have been done on full-scale piles, including single pile and group,linear vibration and nonlinear vibration,to verify the validity of boundary zone model.
基金This work is supported by the National Natural Science Foundation of China (No.21473163, No.21033002, No.21202032) and the National Basic Research Program of China (No.2013CB834604).
文摘The excited state structural dynamics of phenyl absorbing S2(A'), S3(A'), and S6(A') states were troseopy and complete active space self-consistent and the UV absorption bands were assigned on azide (PhN3) after excitation to the light studied using the resonance Raman specfield calculations. The vibrational spectra the basis of the Fourier transform (FT)- Raman, FT-infrared measurements, the density-functional theory computations and the normal mode analysis. The A-, B-, and C-bands resonance Raman spectra in cyclohex- ane, acetonitrile, and methanol solvents were, respectively, obtained at 273.9, 252.7, 245.9, 228.7, 223.1, and 208.8 nm excitation wavelengths to probe the corresponding structural dynamics of PhN3. The results indicated that the structural dynamics in the S2 (A'), S3(A'), and S6(A') states were significantly different. The crossing points of the potential energy surfaces, S2S1(1) and S2S1(2), were predicted to play a key role in the low-lying excited state decay dynamics, in accordance with Kasha's rule, and NT=N8 dissociation. Two decay channels initiated from the Franck-Condon region of the S2(A') state were predicted: the radiative S2,min→S0 radiative decay and the S2→S1 internal conversion through the crossing points S2S1 (1)/S2S1(2).