In this study,we investigate the ef-ficacy of a hybrid parallel algo-rithm aiming at enhancing the speed of evaluation of two-electron repulsion integrals(ERI)and Fock matrix generation on the Hygon C86/DCU(deep compu...In this study,we investigate the ef-ficacy of a hybrid parallel algo-rithm aiming at enhancing the speed of evaluation of two-electron repulsion integrals(ERI)and Fock matrix generation on the Hygon C86/DCU(deep computing unit)heterogeneous computing platform.Multiple hybrid parallel schemes are assessed using a range of model systems,including those with up to 1200 atoms and 10000 basis func-tions.The findings of our research reveal that,during Hartree-Fock(HF)calculations,a single DCU ex-hibits 33.6 speedups over 32 C86 CPU cores.Compared with the efficiency of Wuhan Electronic Structure Package on Intel X86 and NVIDIA A100 computing platform,the Hygon platform exhibits good cost-effective-ness,showing great potential in quantum chemistry calculation and other high-performance scientific computations.展开更多
Readout errors caused by measurement noise are a significant source of errors in quantum circuits,which severely affect the output results and are an urgent problem to be solved in noisy-intermediate scale quantum(NIS...Readout errors caused by measurement noise are a significant source of errors in quantum circuits,which severely affect the output results and are an urgent problem to be solved in noisy-intermediate scale quantum(NISQ)computing.In this paper,we use the bit-flip averaging(BFA)method to mitigate frequent readout errors in quantum generative adversarial networks(QGAN)for image generation,which simplifies the response matrix structure by averaging the qubits for each random bit-flip in advance,successfully solving problems with high cost of measurement for traditional error mitigation methods.Our experiments were simulated in Qiskit using the handwritten digit image recognition dataset under the BFA-based method,the Kullback-Leibler(KL)divergence of the generated images converges to 0.04,0.05,and 0.1 for readout error probabilities of p=0.01,p=0.05,and p=0.1,respectively.Additionally,by evaluating the fidelity of the quantum states representing the images,we observe average fidelity values of 0.97,0.96,and 0.95 for the three readout error probabilities,respectively.These results demonstrate the robustness of the model in mitigating readout errors and provide a highly fault tolerant mechanism for image generation models.展开更多
Recently Zheng & Hwang established a series of independence theorems concerning with planar effective elastic properties. It is manifested that the estimation of the effective elastic properties of microcracked so...Recently Zheng & Hwang established a series of independence theorems concerning with planar effective elastic properties. It is manifested that the estimation of the effective elastic properties of microcracked solids through the generalized self-consistent method (GSCM) contradicts with these independence theorems. In this paper it is shown that such contradiction is actually caused by the approximate algorithm adopted, while the exact solution of GSCM is consistent with these rigorously established independence theorems. Since only an approximate algorithm in GCSM is available in dealing with problems involving non-circular inclusions or holes, an intrinsic GSCM is proposed, which can be performed based on an approximate algorithm and the corresponding estimations are consistent with the independence theorems.展开更多
The effects of plasma screening on the ^(1)P^(o) resonance states of H-and He below the n=3 and n=4 thresholds of the respective subsystemsare investigated using the stabilization method and correlated exponential wav...The effects of plasma screening on the ^(1)P^(o) resonance states of H-and He below the n=3 and n=4 thresholds of the respective subsystemsare investigated using the stabilization method and correlated exponential wave functions.Two plasma mediums,namely,the Debye plasma and quantum plasma environments are considered.The screened Coulomb potential(SCP)obtained from Debye-Hückel model is used to represent Debye plasma environments and the exponential cosine screened Coulomb potential(ECSCP)obtained from a modified Debye-Hückel model is used to represent quantum plasma environments.The resonance parameters(resonance positions and widths)are presented in terms of the screening parameters.展开更多
Reference-frame-independent quantum key distribution(RFI-QKD)can avoid real-time calibration operation of reference frames and improve the efficiency of the communication process.However,due to imperfections of optica...Reference-frame-independent quantum key distribution(RFI-QKD)can avoid real-time calibration operation of reference frames and improve the efficiency of the communication process.However,due to imperfections of optical devices,there will inevitably exist intensity fluctuations in the source side of the QKD system,which will affect the final secure key rate.To reduce the influence of intensity fluctuations,an improved 3-intensity RFI-QKD scheme is proposed in this paper.After considering statistical fluctuations and implementing global parameter optimization,we conduct corresponding simulation analysis.The results show that our present work can present both higher key rate and a farther transmission distance than the standard method.展开更多
Global security threats have motivated organizations to adopt robust and reliable security systems to ensure the safety of individuals and assets.Biometric authentication systems offer a strong solution.However,choosi...Global security threats have motivated organizations to adopt robust and reliable security systems to ensure the safety of individuals and assets.Biometric authentication systems offer a strong solution.However,choosing the best security system requires a structured decision-making framework,especially in complex scenarios involving multiple criteria.To address this problem,we develop a novel quantum spherical fuzzy technique for order preference by similarity to ideal solution(QSF-TOPSIS)methodology,integrating quantum mechanics principles and fuzzy theory.The proposed approach enhances decision-making accuracy,handles uncertainty,and incorporates criteria relationships.Criteria weights are determined using spherical fuzzy sets,and alternatives are ranked through the QSFTOPSIS framework.This comprehensive multi-criteria decision-making(MCDM)approach is applied to identify the optimal gate security system for an organization,considering critical factors such as accuracy,cost,and reliability.Additionally,the study compares the proposed approach with other established MCDM methods.The results confirm the alignment of rankings across these methods,demonstrating the robustness and reliability of the QSF-TOPSIS framework.The study identifies the infrared recognition and identification system(IRIS)as the most effective,with a score value of 0.5280 and optimal security system among the evaluated alternatives.This research contributes to the growing literature on quantum-enhanced decision-making models and offers a practical framework for solving complex,real-world problems involving uncertainty and ambiguity.展开更多
The valence subband energies and wave functions of a tensile strained quantum well are calculated by the plane wave expansion method within the 6×6 Luttinger Kohn model.The effect of the number and period of pla...The valence subband energies and wave functions of a tensile strained quantum well are calculated by the plane wave expansion method within the 6×6 Luttinger Kohn model.The effect of the number and period of plane waves used for expansion on the stability of energy eigenvalues is examined.For practical calculation,it should choose the period large sufficiently to ensure the envelope functions vanish at the boundary and the number of plane waves large enough to ensure the energy eigenvalues keep unchanged within a prescribed range.展开更多
A two-dimensional （2D） full band self-consistent ensemble Monte Carlo （MC） method for solving the quantum Boltzmann equation, including collision broadening and quantum potential corrections, is developed to exten...A two-dimensional （2D） full band self-consistent ensemble Monte Carlo （MC） method for solving the quantum Boltzmann equation, including collision broadening and quantum potential corrections, is developed to extend the MC method to the study of nano-scale semiconductor devices with obvious quantum mechanical （QM） effects. The quantum effects both in real space and momentum space in nano-scale semiconductor devices can be simulated. The effective mobility in the inversion layer of n and p channel MOSFET is simulated and compared with experimental data to verify this method. With this method 50nm ultra thin body silicon on insulator MOSFET are simulated. Results indicate that this method can be used to simulate the 2D QM effects in semiconductor devices including tunnelling effect.展开更多
In this paper, the control laws based on the Lyapunov stability theorem are designed for a two-level open quantum system to prepare the Hadamard gate, which is an important basic gate for the quantum computers. First,...In this paper, the control laws based on the Lyapunov stability theorem are designed for a two-level open quantum system to prepare the Hadamard gate, which is an important basic gate for the quantum computers. First, the density matrix interested in quantum system is transferred to vector formation.Then, in order to obtain a controller with higher accuracy and faster convergence rate, a Lyapunov function based on the matrix logarithm function is designed. After that, a procedure for the controller design is derived based on the Lyapunov stability theorem. Finally, the numerical simulation experiments for an amplitude damping Markovian open quantum system are performed to prepare the desired quantum gate. The simulation results show that the preparation of Hadamard gate based on the proposed control laws can achieve the fidelity up to 0.9985 for the different coupling strengths.展开更多
The spheroidal wave functions are found to have extensive applications in many branches of physics and mathematics. We use the perturbation method in supersymmetric quantum mechanics to obtain the analytic ground eige...The spheroidal wave functions are found to have extensive applications in many branches of physics and mathematics. We use the perturbation method in supersymmetric quantum mechanics to obtain the analytic ground eigenvalue and the ground eigenfunction of the angular spheroidal wave equation at low frequency in a series form. Using this approach, the numerical determinations of the ground eigenvalue and the ground eigenfunction for small complex frequencies are also obtained.展开更多
Employing the Pekeris-type approximation to deal with the pseudo-centrifugal term,we analytically study the pseudospin symmetry of a Dirac nucleon subjected to equal scalar and vector modified Rosen-Morse potential in...Employing the Pekeris-type approximation to deal with the pseudo-centrifugal term,we analytically study the pseudospin symmetry of a Dirac nucleon subjected to equal scalar and vector modified Rosen-Morse potential including the spin-orbit coupling term by using the Nikiforov-Uvarov method and supersymmetric quantum mechanics approach.The complex eigenvalue equation and the total normalized wave functions expressed in terms of Jacobi polynomial with arbitrary spin-orbit coupling quantum number k are presented under the condition of pseudospin symmetry.The eigenvalue equations for both methods reproduce the same result to affirm the mathematical accuracy of analytical calculations.The numerical solutions obtained for different adjustable parameters produce degeneracies for some quantum number.展开更多
Considering the ocean water＇s optical attenuation and the roughness of the sea surface, we analyze the security of continuous-variable （CV） quantum key distribution （QKD） based Mr-to-water channel. The effects of...Considering the ocean water＇s optical attenuation and the roughness of the sea surface, we analyze the security of continuous-variable （CV） quantum key distribution （QKD） based Mr-to-water channel. The effects of the absorp- tion and scattering on the transmittance of underwater quantum channel and the maximum secure transmission distance are studied. Considering the roughness of the sea surface, we simulate the performance bounds of CV QKD with different wind speeds using the Monte Carlo method. The results show that even if the secret key rate gradually reduces as the wind speed increases, the maximum transmission distance will not be affected obviously. Compared to the works regarding short-distance underwater optical communication, our research represents a significant step towards establishing secure communication between air platform and submarine vehicle.展开更多
The selected-state probabilities of collinear ion-pair formation process Na+I2→Na++I2-on Aten-Laming-Los two-State potential energy surface have been calculated by using LCAC-SW method. The results show that reaction...The selected-state probabilities of collinear ion-pair formation process Na+I2→Na++I2-on Aten-Laming-Los two-State potential energy surface have been calculated by using LCAC-SW method. The results show that reaction probabilities are oscillatory with collision energy; the threshold energy of this ioniZation reaction is 2.8 ev, which is in modest agreement with experimental result.展开更多
The alcoholysis mechanism of 1,2-thiazetidine-1,1-dioxide with methanol, in which the relatively stable product is sulfonate ester, has been investigated by quantum chemical method. Our calculations indicate the react...The alcoholysis mechanism of 1,2-thiazetidine-1,1-dioxide with methanol, in which the relatively stable product is sulfonate ester, has been investigated by quantum chemical method. Our calculations indicate the reaction for alcoholysis of 1,2-thiazetidine-1,1-dioxide proceeds via two possible mechanisms: concerted and stepwise. In the stepwise mechanism, two possible reaction pathways can be followed while only one possible reaction pathway can be followed in the concerted mechanism.展开更多
In this paper, the analytical transfer matrix method （ATMM） is applied to study the properties of quantum reflection in three systems： a sech2 barrier, a ramp potential and an inverse harmonic oscillator. Our resul...In this paper, the analytical transfer matrix method （ATMM） is applied to study the properties of quantum reflection in three systems： a sech2 barrier, a ramp potential and an inverse harmonic oscillator. Our results agree with those obtained by Landau and Lifshitz [Landau L D and Lifshitz E M 1977 Quantum Mechanics （Non-relativistic Theory） （New York： Pergamon）], which proves that ATMM is a simple and effective method for quantum reflection.展开更多
Song [Song D 2004 Phys. Rev. A69034301] first proposed two key distribution schemes with the symmetry feature.We find that, in the schemes, the private channels which Alice and Bob publicly announce the initial Bell s...Song [Song D 2004 Phys. Rev. A69034301] first proposed two key distribution schemes with the symmetry feature.We find that, in the schemes, the private channels which Alice and Bob publicly announce the initial Bell state or the measurement result through are not needed in discovering keys, and Song’s encoding methods do not arrive at the optimization.Here, an optimized encoding method is given so that the efficiencies of Song’s schemes are improved by 7/3 times. Interestingly, this optimized encoding method can be extended to the key distribution scheme composed of generalized Bell states.展开更多
The self-consistent Hartree-Fock equation for the He atom is solved using the pseudospectral method. The Feshbach- type autoionization resonance parameters for doubly excited 2s2, 3s2, and 4s2 IS states of He have bee...The self-consistent Hartree-Fock equation for the He atom is solved using the pseudospectral method. The Feshbach- type autoionization resonance parameters for doubly excited 2s2, 3s2, and 4s2 IS states of He have been determined by adding a complex absorbing potential to the Hamiltonian. The Riss-Meyer iterative and Pad6 extrapolation methods are applied to obtain reliable values for the autoionization resonance parameters, which are compared to previous results in the literature.展开更多
The error model of a quantum computer is essential for optimizing quantum algorithms to minimize the impact of errors using quantum error correction or error mitigation.Noise with temporal correlations,e.g.low-frequen...The error model of a quantum computer is essential for optimizing quantum algorithms to minimize the impact of errors using quantum error correction or error mitigation.Noise with temporal correlations,e.g.low-frequency noise and context-dependent noise,is common in quantum computation devices and sometimes even significant.However,conventional tomography methods have not been developed for obtaining an error model describing temporal correlations.In this paper,we propose self-consistent tomography protocols to obtain a model of temporally correlated errors,and we demonstrate that our protocols are efficient for low-frequency noise and context-dependent noise.展开更多
We show that the recently proposed invariant eigenoperator method can be successfully applied to solving the energy levels of an electron in a saddle-potential quantum dot under a uniform magnetic field. The Landau di...We show that the recently proposed invariant eigenoperator method can be successfully applied to solving the energy levels of an electron in a saddle-potential quantum dot under a uniform magnetic field. The Landau diamagnetism decreases with the value wy2 - wx2 due to the existence of the saddle potential.展开更多
An analytical variational method for the ground state of the biased quantum Rabi model in the ultra-strong coupling regime is presented. This analytical variational method can be obtained by a unitary transformation o...An analytical variational method for the ground state of the biased quantum Rabi model in the ultra-strong coupling regime is presented. This analytical variational method can be obtained by a unitary transformation or alternatively by assuming the form of the ground state wave function. The key of the method is to introduce a variational parameter λ,which can be determined by minimizing the energy functional. Using this method, we calculate the physical observables with high accuracy in comparison with the numerical exact ones. Our method evidently improves over the widely used general rotating-wave approximation（GRWA） in both qualitative and quantitative aspects.展开更多
基金supported by the National Natural Science Foundation of China(No.22373112 to Ji Qi,No.22373111 and 21921004 to Minghui Yang)GH-fund A(No.202107011790)。
文摘In this study,we investigate the ef-ficacy of a hybrid parallel algo-rithm aiming at enhancing the speed of evaluation of two-electron repulsion integrals(ERI)and Fock matrix generation on the Hygon C86/DCU(deep computing unit)heterogeneous computing platform.Multiple hybrid parallel schemes are assessed using a range of model systems,including those with up to 1200 atoms and 10000 basis func-tions.The findings of our research reveal that,during Hartree-Fock(HF)calculations,a single DCU ex-hibits 33.6 speedups over 32 C86 CPU cores.Compared with the efficiency of Wuhan Electronic Structure Package on Intel X86 and NVIDIA A100 computing platform,the Hygon platform exhibits good cost-effective-ness,showing great potential in quantum chemistry calculation and other high-performance scientific computations.
基金Project supported by the Natural Science Foundation of Shandong Province,China (Grant No.ZR2021MF049)Joint Fund of Natural Science Foundation of Shandong Province (Grant Nos.ZR2022LLZ012 and ZR2021LLZ001)。
文摘Readout errors caused by measurement noise are a significant source of errors in quantum circuits,which severely affect the output results and are an urgent problem to be solved in noisy-intermediate scale quantum(NISQ)computing.In this paper,we use the bit-flip averaging(BFA)method to mitigate frequent readout errors in quantum generative adversarial networks(QGAN)for image generation,which simplifies the response matrix structure by averaging the qubits for each random bit-flip in advance,successfully solving problems with high cost of measurement for traditional error mitigation methods.Our experiments were simulated in Qiskit using the handwritten digit image recognition dataset under the BFA-based method,the Kullback-Leibler(KL)divergence of the generated images converges to 0.04,0.05,and 0.1 for readout error probabilities of p=0.01,p=0.05,and p=0.1,respectively.Additionally,by evaluating the fidelity of the quantum states representing the images,we observe average fidelity values of 0.97,0.96,and 0.95 for the three readout error probabilities,respectively.These results demonstrate the robustness of the model in mitigating readout errors and provide a highly fault tolerant mechanism for image generation models.
文摘Recently Zheng & Hwang established a series of independence theorems concerning with planar effective elastic properties. It is manifested that the estimation of the effective elastic properties of microcracked solids through the generalized self-consistent method (GSCM) contradicts with these independence theorems. In this paper it is shown that such contradiction is actually caused by the approximate algorithm adopted, while the exact solution of GSCM is consistent with these rigorously established independence theorems. Since only an approximate algorithm in GCSM is available in dealing with problems involving non-circular inclusions or holes, an intrinsic GSCM is proposed, which can be performed based on an approximate algorithm and the corresponding estimations are consistent with the independence theorems.
基金Supported by the Natural Science Foundation of Heilongjiang Province(LH2024A025)。
文摘The effects of plasma screening on the ^(1)P^(o) resonance states of H-and He below the n=3 and n=4 thresholds of the respective subsystemsare investigated using the stabilization method and correlated exponential wave functions.Two plasma mediums,namely,the Debye plasma and quantum plasma environments are considered.The screened Coulomb potential(SCP)obtained from Debye-Hückel model is used to represent Debye plasma environments and the exponential cosine screened Coulomb potential(ECSCP)obtained from a modified Debye-Hückel model is used to represent quantum plasma environments.The resonance parameters(resonance positions and widths)are presented in terms of the screening parameters.
基金financial support from the Industrial Prospect and Key Core Technology Projects of Jiangsu Provincial Key R&D Program(Grant No.BE2022071)the Natural Science Foundation of Jiangsu Province(Grant No.BK20192001)+1 种基金the National Natural Science Foundation of China(Grant No.12074194)the Postgraduate Research&Practice Innovation Program of Jiangsu Province(Grant No.KYCX220954)。
文摘Reference-frame-independent quantum key distribution(RFI-QKD)can avoid real-time calibration operation of reference frames and improve the efficiency of the communication process.However,due to imperfections of optical devices,there will inevitably exist intensity fluctuations in the source side of the QKD system,which will affect the final secure key rate.To reduce the influence of intensity fluctuations,an improved 3-intensity RFI-QKD scheme is proposed in this paper.After considering statistical fluctuations and implementing global parameter optimization,we conduct corresponding simulation analysis.The results show that our present work can present both higher key rate and a farther transmission distance than the standard method.
文摘Global security threats have motivated organizations to adopt robust and reliable security systems to ensure the safety of individuals and assets.Biometric authentication systems offer a strong solution.However,choosing the best security system requires a structured decision-making framework,especially in complex scenarios involving multiple criteria.To address this problem,we develop a novel quantum spherical fuzzy technique for order preference by similarity to ideal solution(QSF-TOPSIS)methodology,integrating quantum mechanics principles and fuzzy theory.The proposed approach enhances decision-making accuracy,handles uncertainty,and incorporates criteria relationships.Criteria weights are determined using spherical fuzzy sets,and alternatives are ranked through the QSFTOPSIS framework.This comprehensive multi-criteria decision-making(MCDM)approach is applied to identify the optimal gate security system for an organization,considering critical factors such as accuracy,cost,and reliability.Additionally,the study compares the proposed approach with other established MCDM methods.The results confirm the alignment of rankings across these methods,demonstrating the robustness and reliability of the QSF-TOPSIS framework.The study identifies the infrared recognition and identification system(IRIS)as the most effective,with a score value of 0.5280 and optimal security system among the evaluated alternatives.This research contributes to the growing literature on quantum-enhanced decision-making models and offers a practical framework for solving complex,real-world problems involving uncertainty and ambiguity.
文摘The valence subband energies and wave functions of a tensile strained quantum well are calculated by the plane wave expansion method within the 6×6 Luttinger Kohn model.The effect of the number and period of plane waves used for expansion on the stability of energy eigenvalues is examined.For practical calculation,it should choose the period large sufficiently to ensure the envelope functions vanish at the boundary and the number of plane waves large enough to ensure the energy eigenvalues keep unchanged within a prescribed range.
基金Project supported by the Special Foundation for State Major Basic Research Program of China （Grant No G2000035602） and the National Natural Science Foundation of China （Grant No 90307006）.
文摘A two-dimensional （2D） full band self-consistent ensemble Monte Carlo （MC） method for solving the quantum Boltzmann equation, including collision broadening and quantum potential corrections, is developed to extend the MC method to the study of nano-scale semiconductor devices with obvious quantum mechanical （QM） effects. The quantum effects both in real space and momentum space in nano-scale semiconductor devices can be simulated. The effective mobility in the inversion layer of n and p channel MOSFET is simulated and compared with experimental data to verify this method. With this method 50nm ultra thin body silicon on insulator MOSFET are simulated. Results indicate that this method can be used to simulate the 2D QM effects in semiconductor devices including tunnelling effect.
基金supported by National Natural Science Foundation of China(61573330)Chinese Academy of Sciences(CAS)the World Academy of Sciences(TWAS)
文摘In this paper, the control laws based on the Lyapunov stability theorem are designed for a two-level open quantum system to prepare the Hadamard gate, which is an important basic gate for the quantum computers. First, the density matrix interested in quantum system is transferred to vector formation.Then, in order to obtain a controller with higher accuracy and faster convergence rate, a Lyapunov function based on the matrix logarithm function is designed. After that, a procedure for the controller design is derived based on the Lyapunov stability theorem. Finally, the numerical simulation experiments for an amplitude damping Markovian open quantum system are performed to prepare the desired quantum gate. The simulation results show that the preparation of Hadamard gate based on the proposed control laws can achieve the fidelity up to 0.9985 for the different coupling strengths.
基金Project supported by the National Natural Science Foundation of China(Grant Nos.10875018 and 10773002)
文摘The spheroidal wave functions are found to have extensive applications in many branches of physics and mathematics. We use the perturbation method in supersymmetric quantum mechanics to obtain the analytic ground eigenvalue and the ground eigenfunction of the angular spheroidal wave equation at low frequency in a series form. Using this approach, the numerical determinations of the ground eigenvalue and the ground eigenfunction for small complex frequencies are also obtained.
文摘Employing the Pekeris-type approximation to deal with the pseudo-centrifugal term,we analytically study the pseudospin symmetry of a Dirac nucleon subjected to equal scalar and vector modified Rosen-Morse potential including the spin-orbit coupling term by using the Nikiforov-Uvarov method and supersymmetric quantum mechanics approach.The complex eigenvalue equation and the total normalized wave functions expressed in terms of Jacobi polynomial with arbitrary spin-orbit coupling quantum number k are presented under the condition of pseudospin symmetry.The eigenvalue equations for both methods reproduce the same result to affirm the mathematical accuracy of analytical calculations.The numerical solutions obtained for different adjustable parameters produce degeneracies for some quantum number.
基金Supported by the National Natural Science Foundation of China under Grant No 61572529
文摘Considering the ocean water＇s optical attenuation and the roughness of the sea surface, we analyze the security of continuous-variable （CV） quantum key distribution （QKD） based Mr-to-water channel. The effects of the absorp- tion and scattering on the transmittance of underwater quantum channel and the maximum secure transmission distance are studied. Considering the roughness of the sea surface, we simulate the performance bounds of CV QKD with different wind speeds using the Monte Carlo method. The results show that even if the secret key rate gradually reduces as the wind speed increases, the maximum transmission distance will not be affected obviously. Compared to the works regarding short-distance underwater optical communication, our research represents a significant step towards establishing secure communication between air platform and submarine vehicle.
文摘The selected-state probabilities of collinear ion-pair formation process Na+I2→Na++I2-on Aten-Laming-Los two-State potential energy surface have been calculated by using LCAC-SW method. The results show that reaction probabilities are oscillatory with collision energy; the threshold energy of this ioniZation reaction is 2.8 ev, which is in modest agreement with experimental result.
文摘The alcoholysis mechanism of 1,2-thiazetidine-1,1-dioxide with methanol, in which the relatively stable product is sulfonate ester, has been investigated by quantum chemical method. Our calculations indicate the reaction for alcoholysis of 1,2-thiazetidine-1,1-dioxide proceeds via two possible mechanisms: concerted and stepwise. In the stepwise mechanism, two possible reaction pathways can be followed while only one possible reaction pathway can be followed in the concerted mechanism.
基金Project supported by Science Foundation of Nantong University (Grant Nos. 03080122 and 09ZY001)
文摘In this paper, the analytical transfer matrix method （ATMM） is applied to study the properties of quantum reflection in three systems： a sech2 barrier, a ramp potential and an inverse harmonic oscillator. Our results agree with those obtained by Landau and Lifshitz [Landau L D and Lifshitz E M 1977 Quantum Mechanics （Non-relativistic Theory） （New York： Pergamon）], which proves that ATMM is a simple and effective method for quantum reflection.
基金supported by the National Natural Science Foundation of China(Grant No.11205115)the Program for Academic Leader Reserve Candidates in Tongling University(Grant No.2014tlxyxs30)the 2014-year Program for Excellent Youth Talents in University of Anhui Province,China
文摘Song [Song D 2004 Phys. Rev. A69034301] first proposed two key distribution schemes with the symmetry feature.We find that, in the schemes, the private channels which Alice and Bob publicly announce the initial Bell state or the measurement result through are not needed in discovering keys, and Song’s encoding methods do not arrive at the optimization.Here, an optimized encoding method is given so that the efficiencies of Song’s schemes are improved by 7/3 times. Interestingly, this optimized encoding method can be extended to the key distribution scheme composed of generalized Bell states.
文摘The self-consistent Hartree-Fock equation for the He atom is solved using the pseudospectral method. The Feshbach- type autoionization resonance parameters for doubly excited 2s2, 3s2, and 4s2 IS states of He have been determined by adding a complex absorbing potential to the Hamiltonian. The Riss-Meyer iterative and Pad6 extrapolation methods are applied to obtain reliable values for the autoionization resonance parameters, which are compared to previous results in the literature.
基金supported by the National Key R&D Program of China(Grant No.2016YFA0301200)the National Basic Research Program of China(Grant No.2014CB921403)+3 种基金supported by Science Challenge Project(Grant No.TZ2017003)the National Natural Science Foundation of China(Grants No.11774024,No.11534002,and No.U1530401)supported by National Natural Science Foundation of China(Grant No.11875050,12088101)NSAF(Grant No.U1930403)。
文摘The error model of a quantum computer is essential for optimizing quantum algorithms to minimize the impact of errors using quantum error correction or error mitigation.Noise with temporal correlations,e.g.low-frequency noise and context-dependent noise,is common in quantum computation devices and sometimes even significant.However,conventional tomography methods have not been developed for obtaining an error model describing temporal correlations.In this paper,we propose self-consistent tomography protocols to obtain a model of temporally correlated errors,and we demonstrate that our protocols are efficient for low-frequency noise and context-dependent noise.
基金supported by the Doctoral Scientific Research Startup Fund of Anhui University,China (Grant No. 33190059)the National Natural Science Foundation of China (Grant No. 10874174)+1 种基金the President Foundation of the Chinese Academy of Sciencesthe Open Fund of the State Key Laboratory for Infrared Physics
文摘We show that the recently proposed invariant eigenoperator method can be successfully applied to solving the energy levels of an electron in a saddle-potential quantum dot under a uniform magnetic field. The Landau diamagnetism decreases with the value wy2 - wx2 due to the existence of the saddle potential.
基金Project supported by the National Natural Science Foundation of China(Grant Nos.11674139,11604009,and 11704025)the Program for Changjiang Scholars and Innovative Research Team in University,China(Grant No.IRT-16R35)+1 种基金the Fundamental Research Funds for the Central Universities,Chinathe financial support of the Future and Emerging Technologies(FET)programme within the Seventh Framework Programme for Research of the European Commission,under FET-Open Grant No.618083(CNTQC)
文摘An analytical variational method for the ground state of the biased quantum Rabi model in the ultra-strong coupling regime is presented. This analytical variational method can be obtained by a unitary transformation or alternatively by assuming the form of the ground state wave function. The key of the method is to introduce a variational parameter λ,which can be determined by minimizing the energy functional. Using this method, we calculate the physical observables with high accuracy in comparison with the numerical exact ones. Our method evidently improves over the widely used general rotating-wave approximation（GRWA） in both qualitative and quantitative aspects.
