We investigate the geometries and energies of seven electronic states X-1A1, A1B1, a-3B1, B-1A2,b-3A2, C1B2 and c-3B2 of CF2 carbene using internally contracted multireference configuration interaction methods includi...We investigate the geometries and energies of seven electronic states X-1A1, A1B1, a-3B1, B-1A2,b-3A2, C1B2 and c-3B2 of CF2 carbene using internally contracted multireference configuration interaction methods including Davidson correction （icMRCIq-Q） with different basis sets aug-cc-pVXZ （X=T, Q, 5）. For the first time, the potential energy curves of electronic states of CF2 related icMRCI＋Q/aug-cc-pVTZ level. The ab initio results will and dynamics of electronic states of CF2 radical. to the lowest dissociation limit are calculated at the further increase our understanding of the structures展开更多
We give a detailed examination of potential energy curves of the singlet and triplet states of CFC1 correlated with the lowest three dissociation limits. The calculations are carried out at the internally contracted m...We give a detailed examination of potential energy curves of the singlet and triplet states of CFC1 correlated with the lowest three dissociation limits. The calculations are carried out at the internally contracted multi- reference configuration interaction/cc-pV（T＋d）Z level with the other two geometric parameters fixed at the state equilibrium conformation. The vertical transition energy, the oscillator strength, the main configuration and the electron transition are also investigated at the same level.展开更多
Objective:To evaluate the therapeutic efficacy of the umbilical acupuncture’s“Wind-Thunder Interaction Method”in treating schizophrenia(SCH)patients with liver stagnation and spleen deficiency.Methods:A total of 12...Objective:To evaluate the therapeutic efficacy of the umbilical acupuncture’s“Wind-Thunder Interaction Method”in treating schizophrenia(SCH)patients with liver stagnation and spleen deficiency.Methods:A total of 120 SCH patients with liver stagnation and spleen deficiency were selected and evenly divided by ball drawing.The umbilical acupuncture group received the“Wind-Thunder Interaction Method”,while the Western medicine group received pure Western medicine treatment.The outcomes were compared in terms of efficacy and other indicators.Results:The umbilical acupuncture group showed a higher total effective rate,a decrease in disease symptom scores,lower scores on the side effect rating scale,improved cognitive function scores,and excellent laboratory indicators,with p<0.05 between the groups.Conclusion:The“Wind-Thunder Interaction Method”of umbilical acupuncture demonstrated a relatively high effectiveness in treating SCH patients with liver stagnation and spleen deficiency,alleviating symptoms,reducing side effects,improving cognitive function,and facilitating the recovery of neuro-vascular regulatory peptide groups.展开更多
The fluid-structure interaction may occur in space launch vehicles,which would lead to bad performance of vehicles,damage equipments on vehicles,or even affect astronauts＇ health.In this paper,analysis on dynamic beh...The fluid-structure interaction may occur in space launch vehicles,which would lead to bad performance of vehicles,damage equipments on vehicles,or even affect astronauts＇ health.In this paper,analysis on dynamic behavior of liquid oxygen （LOX） feeding pipe system in a large scale launch vehicle is performed,with the effect of fluid-structure interaction （FSI） taken into consideration.The pipe system is simplified as a planar FSI model with Poisson coupling and junction coupling.Numerical tests on pipes between the tank and the pump are solved by the finite volume method.Results show that restrictions weaken the interaction between axial and lateral vibrations.The reasonable results regarding frequencies and modes indicate that the FSI affects substantially the dynamic analysis,and thus highlight the usefulness of the proposed model.This study would provide a reference to the pipe test,as well as facilitate further studies on oscillation suppression.展开更多
The Balise Transmission Module(BTM)unit of the on-board train control system is a crucial component.Due to its unique installation position and complex environment,this unit has a higher fault rate within the on-board...The Balise Transmission Module(BTM)unit of the on-board train control system is a crucial component.Due to its unique installation position and complex environment,this unit has a higher fault rate within the on-board train control system.To conduct fault prediction for the BTM unit based on actual fault data,this study proposes a prediction method combining reliability statistics and machine learning,and achieves the fusion of prediction results from different dimensions through multi-method interactive validation.Firstly,a method for predicting equipment fault time targeting batch equipment is introduced.This method utilizes reliability statistics to construct a model of the remaining faultless operating time distribution considering uncertainty,thereby predicting the remaining faultless operating probability of the BTM unit.Secondly,considering the complexity of the BTM unit’s fault mechanism,the small sample size of fault cases,and the potential presence of multiple fault features in fault text records,an individual-oriented fault prediction method based on Bayesian-optimized Gradient Boosting Regression Tree(Bayes-GBRT)is proposed.This method achieves better prediction results compared to linear regression algorithms and random forest regression algorithms,with an average absolute error of only 0.224 years for predicting the fault time of this type of equipment.Finally,a multi-method interactive validation approach is proposed,enabling the fusion and validation of multi-dimensional results.The results indicate that the predicted fault time and the actual fault time conform to a log-normal distribution,and the parameter estimation results are basically consistent,verifying the accuracy and effectiveness of the prediction results.The above research findings can provide technical support for the maintenance and modification of BTM units,effectively reducing maintenance costs and ensuring the safe operation of high-speed railway,thus having practical engineering value for preventive maintenance.展开更多
The work is devoted to the demonstration of the possibility of applying the formulas of information handling obtained in the theory of non-force interaction for the natural language processing. These formulas were obt...The work is devoted to the demonstration of the possibility of applying the formulas of information handling obtained in the theory of non-force interaction for the natural language processing. These formulas were obtained in computer experiments in modelling the movement and interaction of material objects by changing the amount of information that triggers this movement. The hypothesis, objective and tasks of the experimental research were defined. The methods and software tools were developed to conduct the experiments. To compare different results of the simulation of the processes in a human brain during speech production, there was a range of methods proposed to calculate the estimate of sequence of fragments of natural language texts including the methods based on linear approximation. The experiments confirmed that the formulas of information handling obtained in the theory of non-force interaction reflect the processes of language formation. It is shown that the offered approach can successfully be used to create systems of reactive artificial intelligence machines. Experimental and, presented in this work, practical results constitute that the non-force (informational) interaction formulae are generally valid.展开更多
Extended finite element method （XFEM） implementation of the interaction integral methodology for evaluating the stress intensity factors （SIF） of the mixed-mode crack problem is presented. A discontinuous function...Extended finite element method （XFEM） implementation of the interaction integral methodology for evaluating the stress intensity factors （SIF） of the mixed-mode crack problem is presented. A discontinuous function and the near-tip asymptotic function are added to the classic finite element approximation to model the crack behavior. Two-state integral by the superposition of actual and auxiliary fields is derived to calculate the SIFs. Applications of the proposed technique to the inclined centre crack plate with inclined angle from 0° to 90° and slant edge crack plate with slant angle 45°, 67.5° and 90° are presented, and comparisons are made with closed form solutions. The results show that the proposed method is convenient, accurate and computationallv efficient.展开更多
In this paper, we propose an interactive method for solving the multilevel linear programming problems based on the intuitionistic fuzzy set theory. Firstly, the membership function and the non-membership function are...In this paper, we propose an interactive method for solving the multilevel linear programming problems based on the intuitionistic fuzzy set theory. Firstly, the membership function and the non-membership function are introduced to describe the uncertainty of the decision makers. Secondly, a satisfactory solution is derived by updating the minimum satisfactory degrees with considerations of the overall satisfactory balance among all levels. In addition, the steps of the proposed method are given in this paper. Finally, numerical examples illustrate the feasibility of this method.展开更多
The consistent tanh expansion(CTE) method is applied to the(2+1)-dimensional Boussinesq equation which describes the propagation of ultrashort pulse in quadratic nonlinear medium. The interaction solutions are explici...The consistent tanh expansion(CTE) method is applied to the(2+1)-dimensional Boussinesq equation which describes the propagation of ultrashort pulse in quadratic nonlinear medium. The interaction solutions are explicitly given, such as the bright soliton-periodic wave interaction solution, variational amplitude periodic wave solution,and kink-periodic wave interaction solution. We also obtain the bright soliton solution, kind bright soliton solution, double well dark soliton solution and kink-bright soliton interaction solution by using Painlev′e truncated expansion method.And we investigate interactive properties of solitons and periodic waves.展开更多
A pharmacological interaction target (PIT) method for solving the difficult problem in the separation of taxol from cephalonmanine was proposed. A two-phase extraction technique was used to carry out the PIT separatio...A pharmacological interaction target (PIT) method for solving the difficult problem in the separation of taxol from cephalonmanine was proposed. A two-phase extraction technique was used to carry out the PIT separation process. The effects of buffer, temperature and protein on the separation were investigated. Feasible disassembly conditions were also discussed. The final purity of taxol can reach 95% or higher.展开更多
The consistent tanh expansion(CTE) method is employed to the(2+1)-dimensional Caudrey–Dodd–Gibbon–Kotera–Sawada(CDGKS) equation. The interaction solutions between solitons and the cnoidal periodic waves are explic...The consistent tanh expansion(CTE) method is employed to the(2+1)-dimensional Caudrey–Dodd–Gibbon–Kotera–Sawada(CDGKS) equation. The interaction solutions between solitons and the cnoidal periodic waves are explicitly obtained. Concretely, we discuss a special kind of interaction solution in the form of tanh functions and Jacobian elliptic functions in both analytical and graphical ways. The results show that the profiles of the soliton-cnoidal periodic wave interaction solutions can be designed by choosing different values of wave parameters.展开更多
In the stage of senior high school education, senior high school Chinese is an important basic subject. There are various teaching methods in Chinese teaching in senior high schools, and interactive teaching method is...In the stage of senior high school education, senior high school Chinese is an important basic subject. There are various teaching methods in Chinese teaching in senior high schools, and interactive teaching method is a common teaching method. Through good interaction between teachers and students, an efficient Chinese classroom can be constructed. Students can learn and master more Chinese knowledge in the limited classroom learning time. At the same time, the Chinese interactive teaching method can also expand the students thinking of language and literature study, so that students can be inspired and educated through the interactive communication between teachers and students and between students. It is beneficial for students to study Chinese more deeply and comprehensively and further improve their Chinese learning level.展开更多
It is important to study the subgrade characteristics of high-speed railways in consideration of the water–soil coupling dynamic problem,especially when high-speed trains operate in rainy regions.This study develops ...It is important to study the subgrade characteristics of high-speed railways in consideration of the water–soil coupling dynamic problem,especially when high-speed trains operate in rainy regions.This study develops a nonlinear water–soil interaction dynamic model of slab track coupling with subgrade under high-speed train loading based on vehicle–track coupling dynamics.By using this model,the basic dynamic characteristics,including water–soil interaction and without water induced by the high-speed train loading,are studied.The main factors-the permeability coefficien and the porosity-influencin the subgrade deformation are investigated.The developed model can characterize the soil dynamic behaviour more realistically,especially when considering the influenc of water-rich soil.展开更多
At present,in the high school English classroom teaching,there are still some problems,which is an obstacle to hinder the smooth development of English teaching,in this case,in order to improve the efficiency of the h...At present,in the high school English classroom teaching,there are still some problems,which is an obstacle to hinder the smooth development of English teaching,in this case,in order to improve the efficiency of the high school English teaching,the use of this method has been used which can largely improve the students’interest in learning,to build interesting class.This paper analyzes the application of interactive teaching method in English classroom teaching for reference.展开更多
Rashba effect in presence of a time-dependent interaction has been considered.Then time-evolution of such a system has been studied by using Lewis–Riesenfeld dynamical invariant and unitary transformation method.So a...Rashba effect in presence of a time-dependent interaction has been considered.Then time-evolution of such a system has been studied by using Lewis–Riesenfeld dynamical invariant and unitary transformation method.So appropriate dynamical invariant and unitary transformation according the considered system have been constructed as well as some special cases have come into this article which are common in physics.展开更多
The potential energy curves（PECs） of the first electronic excited state of S2（a^1△g） are calculated employing a multi-reference configuration interaction method with the Davidson correction in combination with a ...The potential energy curves（PECs） of the first electronic excited state of S2（a^1△g） are calculated employing a multi-reference configuration interaction method with the Davidson correction in combination with a series of correlationconsistent basis sets from Dunning： aug-cc-p VX Z（X = T, Q, 5, 6）. In order to obtain PECs with high accuracy, PECs calculated with aug-cc-p V（Q, 5）Z basis sets are extrapolated to the complete basis set limit. The resulting PECs are then fitted to the analytical potential energy function（APEF） using the extended Hartree–Fock approximate correlation energy method. By utilizing the fitted APEF, accurate and reliable spectroscopic parameters are obtained, which are consistent with both experimental and theoretical results. By solving the Schr o¨dinger equation numerically with the APEFs obtained at the AV6 Z and the extrapolated AV（Q, 5）Z level of theory, we calculate the complete set of vibrational levels, classical turning points, inertial rotation and centrifugal distortion constants.展开更多
A globally accurate potential energy surface is reported for the electronic ground-state H2O＋. The ab initio energies utilized to map the potential energy surface are calculated at the multireference configuration in...A globally accurate potential energy surface is reported for the electronic ground-state H2O＋. The ab initio energies utilized to map the potential energy surface are calculated at the multireference configuration interaction method employing the aug-cc-pVQZ basis set and the full valence complete active space wave function as reference. In order to improve accu- racy of the resulting raw ab initio energies, they are then extrapolated to the complete basis set limit and most importantly to the full configuration-interaction limit by semiempirically correcting the dynamical correlation using the double many- body expansion-scaled external correlation method. The topographical features of the current potential energy surface were examined in detail, which agree nicely with those of other theoretical work.展开更多
The potential energy curves （PECs） of X2∑ and A2П states of the CN molecule have been calculated with the multi- reference configuration interaction method and the aug-cc-pwCVSZ basis set. Based on the PECs, all o...The potential energy curves （PECs） of X2∑ and A2П states of the CN molecule have been calculated with the multi- reference configuration interaction method and the aug-cc-pwCVSZ basis set. Based on the PECs, all of the vibrational and rotational levels of the 13C14N molecule are obtained by solving the Schrrdinger equation of the molecular nuclear motion. The spectroscopic parameters are determined by fitting the Dunham coefficients with the levels. Both the levels and the spectroscopic parameters are in good qualitative agreement with the experimental data available. The analytical potential energy functions are also deduced from the calculated PECs. The present results can provide a helpful reference for future spectroscopy experiments or dynamical calculations of the molecule.展开更多
In this work we will theoretically study the ground-state electronic structure of three-electron polygonal quantum dots by means of the configuration interaction method. Transition from a weakly correlated regime to a...In this work we will theoretically study the ground-state electronic structure of three-electron polygonal quantum dots by means of the configuration interaction method. Transition from a weakly correlated regime to a strongly correlated regime is investigated for quantum dots with hexagonal, square, and triangular geometries. Our numerical results reveal that the ground-state spin and the charge density distribution of the system are sensitive to the shape of the quantum dot.展开更多
基金Supported by the 2014 Postdoctoral Sustentation Fund of Qingdao under Grant No 01020120517the Natural Science Foundation of Shandong Province under Grant No ZR2014AP001+1 种基金the National Natural Science Foundation of China under Grant No11447226the Scientific Research Foundation of Shandong University of Science and Technology for Recruited Talents under Grant No 2015RCJJ015
文摘We investigate the geometries and energies of seven electronic states X-1A1, A1B1, a-3B1, B-1A2,b-3A2, C1B2 and c-3B2 of CF2 carbene using internally contracted multireference configuration interaction methods including Davidson correction （icMRCIq-Q） with different basis sets aug-cc-pVXZ （X=T, Q, 5）. For the first time, the potential energy curves of electronic states of CF2 related icMRCI＋Q/aug-cc-pVTZ level. The ab initio results will and dynamics of electronic states of CF2 radical. to the lowest dissociation limit are calculated at the further increase our understanding of the structures
基金Supported by the National Natural Science Foundation of China under Grant No 11447148
文摘We give a detailed examination of potential energy curves of the singlet and triplet states of CFC1 correlated with the lowest three dissociation limits. The calculations are carried out at the internally contracted multi- reference configuration interaction/cc-pV（T＋d）Z level with the other two geometric parameters fixed at the state equilibrium conformation. The vertical transition energy, the oscillator strength, the main configuration and the electron transition are also investigated at the same level.
文摘Objective:To evaluate the therapeutic efficacy of the umbilical acupuncture’s“Wind-Thunder Interaction Method”in treating schizophrenia(SCH)patients with liver stagnation and spleen deficiency.Methods:A total of 120 SCH patients with liver stagnation and spleen deficiency were selected and evenly divided by ball drawing.The umbilical acupuncture group received the“Wind-Thunder Interaction Method”,while the Western medicine group received pure Western medicine treatment.The outcomes were compared in terms of efficacy and other indicators.Results:The umbilical acupuncture group showed a higher total effective rate,a decrease in disease symptom scores,lower scores on the side effect rating scale,improved cognitive function scores,and excellent laboratory indicators,with p<0.05 between the groups.Conclusion:The“Wind-Thunder Interaction Method”of umbilical acupuncture demonstrated a relatively high effectiveness in treating SCH patients with liver stagnation and spleen deficiency,alleviating symptoms,reducing side effects,improving cognitive function,and facilitating the recovery of neuro-vascular regulatory peptide groups.
文摘The fluid-structure interaction may occur in space launch vehicles,which would lead to bad performance of vehicles,damage equipments on vehicles,or even affect astronauts＇ health.In this paper,analysis on dynamic behavior of liquid oxygen （LOX） feeding pipe system in a large scale launch vehicle is performed,with the effect of fluid-structure interaction （FSI） taken into consideration.The pipe system is simplified as a planar FSI model with Poisson coupling and junction coupling.Numerical tests on pipes between the tank and the pump are solved by the finite volume method.Results show that restrictions weaken the interaction between axial and lateral vibrations.The reasonable results regarding frequencies and modes indicate that the FSI affects substantially the dynamic analysis,and thus highlight the usefulness of the proposed model.This study would provide a reference to the pipe test,as well as facilitate further studies on oscillation suppression.
基金supported by the Integrated Rail Transit Dispatch Control and Intermodal Transport Service Technology Project(Grant No.2022YFB4300500).
文摘The Balise Transmission Module(BTM)unit of the on-board train control system is a crucial component.Due to its unique installation position and complex environment,this unit has a higher fault rate within the on-board train control system.To conduct fault prediction for the BTM unit based on actual fault data,this study proposes a prediction method combining reliability statistics and machine learning,and achieves the fusion of prediction results from different dimensions through multi-method interactive validation.Firstly,a method for predicting equipment fault time targeting batch equipment is introduced.This method utilizes reliability statistics to construct a model of the remaining faultless operating time distribution considering uncertainty,thereby predicting the remaining faultless operating probability of the BTM unit.Secondly,considering the complexity of the BTM unit’s fault mechanism,the small sample size of fault cases,and the potential presence of multiple fault features in fault text records,an individual-oriented fault prediction method based on Bayesian-optimized Gradient Boosting Regression Tree(Bayes-GBRT)is proposed.This method achieves better prediction results compared to linear regression algorithms and random forest regression algorithms,with an average absolute error of only 0.224 years for predicting the fault time of this type of equipment.Finally,a multi-method interactive validation approach is proposed,enabling the fusion and validation of multi-dimensional results.The results indicate that the predicted fault time and the actual fault time conform to a log-normal distribution,and the parameter estimation results are basically consistent,verifying the accuracy and effectiveness of the prediction results.The above research findings can provide technical support for the maintenance and modification of BTM units,effectively reducing maintenance costs and ensuring the safe operation of high-speed railway,thus having practical engineering value for preventive maintenance.
文摘The work is devoted to the demonstration of the possibility of applying the formulas of information handling obtained in the theory of non-force interaction for the natural language processing. These formulas were obtained in computer experiments in modelling the movement and interaction of material objects by changing the amount of information that triggers this movement. The hypothesis, objective and tasks of the experimental research were defined. The methods and software tools were developed to conduct the experiments. To compare different results of the simulation of the processes in a human brain during speech production, there was a range of methods proposed to calculate the estimate of sequence of fragments of natural language texts including the methods based on linear approximation. The experiments confirmed that the formulas of information handling obtained in the theory of non-force interaction reflect the processes of language formation. It is shown that the offered approach can successfully be used to create systems of reactive artificial intelligence machines. Experimental and, presented in this work, practical results constitute that the non-force (informational) interaction formulae are generally valid.
基金Projects(41172244,41072224) supported by the National Natural Science Foundation of ChinaProject(2009GGJS-037) supported by the Foundation of Youths Key Teacher by the Henan Educational Committee,China
文摘Extended finite element method （XFEM） implementation of the interaction integral methodology for evaluating the stress intensity factors （SIF） of the mixed-mode crack problem is presented. A discontinuous function and the near-tip asymptotic function are added to the classic finite element approximation to model the crack behavior. Two-state integral by the superposition of actual and auxiliary fields is derived to calculate the SIFs. Applications of the proposed technique to the inclined centre crack plate with inclined angle from 0° to 90° and slant edge crack plate with slant angle 45°, 67.5° and 90° are presented, and comparisons are made with closed form solutions. The results show that the proposed method is convenient, accurate and computationallv efficient.
基金Supported by the National Natural Science Foundation of China(71471140,71171150,71103135)
文摘In this paper, we propose an interactive method for solving the multilevel linear programming problems based on the intuitionistic fuzzy set theory. Firstly, the membership function and the non-membership function are introduced to describe the uncertainty of the decision makers. Secondly, a satisfactory solution is derived by updating the minimum satisfactory degrees with considerations of the overall satisfactory balance among all levels. In addition, the steps of the proposed method are given in this paper. Finally, numerical examples illustrate the feasibility of this method.
基金Supported by the National Natural Science Foundation of Zhejiang Province under Grant No.LZ15A050001the National Natural Science Foundation of China under Grant No.11675146
文摘The consistent tanh expansion(CTE) method is applied to the(2+1)-dimensional Boussinesq equation which describes the propagation of ultrashort pulse in quadratic nonlinear medium. The interaction solutions are explicitly given, such as the bright soliton-periodic wave interaction solution, variational amplitude periodic wave solution,and kink-periodic wave interaction solution. We also obtain the bright soliton solution, kind bright soliton solution, double well dark soliton solution and kink-bright soliton interaction solution by using Painlev′e truncated expansion method.And we investigate interactive properties of solitons and periodic waves.
基金Supported by the National Natural Science Foundation of China (No.29606007).
文摘A pharmacological interaction target (PIT) method for solving the difficult problem in the separation of taxol from cephalonmanine was proposed. A two-phase extraction technique was used to carry out the PIT separation process. The effects of buffer, temperature and protein on the separation were investigated. Feasible disassembly conditions were also discussed. The final purity of taxol can reach 95% or higher.
基金Supported by the National Natural Science Foundation of China under Grant No.11505154the Zhejiang Provincial Natural Science Foundation of China under Grant No.LQ16A010003the Scientific Research Foundation for Doctoral Program of Zhejiang Ocean University under Grant No.Q1511
文摘The consistent tanh expansion(CTE) method is employed to the(2+1)-dimensional Caudrey–Dodd–Gibbon–Kotera–Sawada(CDGKS) equation. The interaction solutions between solitons and the cnoidal periodic waves are explicitly obtained. Concretely, we discuss a special kind of interaction solution in the form of tanh functions and Jacobian elliptic functions in both analytical and graphical ways. The results show that the profiles of the soliton-cnoidal periodic wave interaction solutions can be designed by choosing different values of wave parameters.
文摘In the stage of senior high school education, senior high school Chinese is an important basic subject. There are various teaching methods in Chinese teaching in senior high schools, and interactive teaching method is a common teaching method. Through good interaction between teachers and students, an efficient Chinese classroom can be constructed. Students can learn and master more Chinese knowledge in the limited classroom learning time. At the same time, the Chinese interactive teaching method can also expand the students thinking of language and literature study, so that students can be inspired and educated through the interactive communication between teachers and students and between students. It is beneficial for students to study Chinese more deeply and comprehensively and further improve their Chinese learning level.
基金supported by the National Natural Science Foundation of China (Grants U1134202,51305360)the National Basic Research Programof China(Grant2011CB711103)the 2015 Doctoral Innovation Funds of Southwest Jiaotong University
文摘It is important to study the subgrade characteristics of high-speed railways in consideration of the water–soil coupling dynamic problem,especially when high-speed trains operate in rainy regions.This study develops a nonlinear water–soil interaction dynamic model of slab track coupling with subgrade under high-speed train loading based on vehicle–track coupling dynamics.By using this model,the basic dynamic characteristics,including water–soil interaction and without water induced by the high-speed train loading,are studied.The main factors-the permeability coefficien and the porosity-influencin the subgrade deformation are investigated.The developed model can characterize the soil dynamic behaviour more realistically,especially when considering the influenc of water-rich soil.
文摘At present,in the high school English classroom teaching,there are still some problems,which is an obstacle to hinder the smooth development of English teaching,in this case,in order to improve the efficiency of the high school English teaching,the use of this method has been used which can largely improve the students’interest in learning,to build interesting class.This paper analyzes the application of interactive teaching method in English classroom teaching for reference.
文摘Rashba effect in presence of a time-dependent interaction has been considered.Then time-evolution of such a system has been studied by using Lewis–Riesenfeld dynamical invariant and unitary transformation method.So appropriate dynamical invariant and unitary transformation according the considered system have been constructed as well as some special cases have come into this article which are common in physics.
基金Project supported by the National Natural Science Foundation of China(Grant Nos.11304185 and 11074151)
文摘The potential energy curves（PECs） of the first electronic excited state of S2（a^1△g） are calculated employing a multi-reference configuration interaction method with the Davidson correction in combination with a series of correlationconsistent basis sets from Dunning： aug-cc-p VX Z（X = T, Q, 5, 6）. In order to obtain PECs with high accuracy, PECs calculated with aug-cc-p V（Q, 5）Z basis sets are extrapolated to the complete basis set limit. The resulting PECs are then fitted to the analytical potential energy function（APEF） using the extended Hartree–Fock approximate correlation energy method. By utilizing the fitted APEF, accurate and reliable spectroscopic parameters are obtained, which are consistent with both experimental and theoretical results. By solving the Schr o¨dinger equation numerically with the APEFs obtained at the AV6 Z and the extrapolated AV（Q, 5）Z level of theory, we calculate the complete set of vibrational levels, classical turning points, inertial rotation and centrifugal distortion constants.
基金Project supported by the National Natural Science Foundation of China(Grant Nos.11304185 and 11074151)China Postdoctoral Science Foundation(Grant No.2014M561957)+1 种基金the Postdoctoral Innovation Project of Shandong Province,China(Grant No.201402013)the Shandong Provincial Natural Science Foundation,China(Grant No.ZR2014AM022)
文摘A globally accurate potential energy surface is reported for the electronic ground-state H2O＋. The ab initio energies utilized to map the potential energy surface are calculated at the multireference configuration interaction method employing the aug-cc-pVQZ basis set and the full valence complete active space wave function as reference. In order to improve accu- racy of the resulting raw ab initio energies, they are then extrapolated to the complete basis set limit and most importantly to the full configuration-interaction limit by semiempirically correcting the dynamical correlation using the double many- body expansion-scaled external correlation method. The topographical features of the current potential energy surface were examined in detail, which agree nicely with those of other theoretical work.
基金supported by the National Natural Science Foundation of China(Grant Nos.11174117 and 11374132)the Program for Scientific Research Innovation Team in Colleges and Universities of Shandong Province,China
文摘The potential energy curves （PECs） of X2∑ and A2П states of the CN molecule have been calculated with the multi- reference configuration interaction method and the aug-cc-pwCVSZ basis set. Based on the PECs, all of the vibrational and rotational levels of the 13C14N molecule are obtained by solving the Schrrdinger equation of the molecular nuclear motion. The spectroscopic parameters are determined by fitting the Dunham coefficients with the levels. Both the levels and the spectroscopic parameters are in good qualitative agreement with the experimental data available. The analytical potential energy functions are also deduced from the calculated PECs. The present results can provide a helpful reference for future spectroscopy experiments or dynamical calculations of the molecule.
文摘In this work we will theoretically study the ground-state electronic structure of three-electron polygonal quantum dots by means of the configuration interaction method. Transition from a weakly correlated regime to a strongly correlated regime is investigated for quantum dots with hexagonal, square, and triangular geometries. Our numerical results reveal that the ground-state spin and the charge density distribution of the system are sensitive to the shape of the quantum dot.
