Using piecewise constant orthonormal functions, an approximation of the monodromy operator of a Linear Periodic Delay Differential Equation (PDDE) is obtained by approximating the integral equation corresponding to th...Using piecewise constant orthonormal functions, an approximation of the monodromy operator of a Linear Periodic Delay Differential Equation (PDDE) is obtained by approximating the integral equation corresponding to the PDDE as a linear operator over the space of initial conditions. This approximation allows us to consider the state space as finite dimensional resulting in a finite matrix approximation whose spectrum converges to the spectrum of the monodromy operator.展开更多
Structures of two classes of solvable subgroups in SL（3, C） are given in this paper, and the integrability of the 3-order Fuchsian equation which is integrable in the sense that its monodromy group is solvable is di...Structures of two classes of solvable subgroups in SL（3, C） are given in this paper, and the integrability of the 3-order Fuchsian equation which is integrable in the sense that its monodromy group is solvable is discussed.展开更多
Direct dynamics simulations are a useful and general approach for studying the atomistic properties of complex chemical systems because they do not require fitting an analytic potential energy function.Hessian-based p...Direct dynamics simulations are a useful and general approach for studying the atomistic properties of complex chemical systems because they do not require fitting an analytic potential energy function.Hessian-based predictor-corrector integrators are a widely used approach for calculating the trajectories of moving atoms in direct dynamics simulations.We employ a monodromy matrix to propose a tool for evaluating the accuracy of integrators in the trajectory calculation.We choose a general velocity Verlet as a different object.We also simulate molecular with hydrogen(CO_2) and molecular with hydrogen(H_2O) motions.Comparing the eigenvalues of monodromy matrix,many simulations show that Hessian-based predictor-corrector integrators perform well for Hessian updates and non-Hessian updates.Hessian-based predictor-corrector integrator with Hessian update has a strong performance in the H_2O simulations.Hessian-based predictor-corrector integrator with Hessian update has a strong performance when the integrating step of the velocity Verlet approach is tripled for the predicting step.In the CO_2 simulations,a strong performance occurs when the integrating step is a multiple of five.展开更多
文摘Using piecewise constant orthonormal functions, an approximation of the monodromy operator of a Linear Periodic Delay Differential Equation (PDDE) is obtained by approximating the integral equation corresponding to the PDDE as a linear operator over the space of initial conditions. This approximation allows us to consider the state space as finite dimensional resulting in a finite matrix approximation whose spectrum converges to the spectrum of the monodromy operator.
文摘Structures of two classes of solvable subgroups in SL（3, C） are given in this paper, and the integrability of the 3-order Fuchsian equation which is integrable in the sense that its monodromy group is solvable is discussed.
基金Project(2016JJ2029)supported by Hunan Provincial Natural Science Foundation of ChinaProject(2016WLZC014)supported by the Open Research Fund of Hunan Provincial Key Laboratory of Network Investigational TechnologyProject(2015HNWLFZ059)supported by the Open Research Fund of Key Laboratory of Network Crime Investigation of Hunan Provincial Colleges,China
文摘Direct dynamics simulations are a useful and general approach for studying the atomistic properties of complex chemical systems because they do not require fitting an analytic potential energy function.Hessian-based predictor-corrector integrators are a widely used approach for calculating the trajectories of moving atoms in direct dynamics simulations.We employ a monodromy matrix to propose a tool for evaluating the accuracy of integrators in the trajectory calculation.We choose a general velocity Verlet as a different object.We also simulate molecular with hydrogen(CO_2) and molecular with hydrogen(H_2O) motions.Comparing the eigenvalues of monodromy matrix,many simulations show that Hessian-based predictor-corrector integrators perform well for Hessian updates and non-Hessian updates.Hessian-based predictor-corrector integrator with Hessian update has a strong performance in the H_2O simulations.Hessian-based predictor-corrector integrator with Hessian update has a strong performance when the integrating step of the velocity Verlet approach is tripled for the predicting step.In the CO_2 simulations,a strong performance occurs when the integrating step is a multiple of five.
