Efficient FinDiff algorithm with optimal phase properties for problems in quantum chemistry

Finite difference and finite volume methods for ordinary differential equations (65L12) Numerical methods for initial value problems involving ordinary differential equations (65L05)

Cites Work

Phase fitted algorithm for problems in quantum chemistry
A new class of explicit two-step fourth order methods for \(y=f(t,y)\) with extended intervals of periodicity
Coleman's method maximally adapted to the Schrödinger equation
Families of fifth order Nyström methods for y=f(x,y) and intervals of periodicity
Analysis of a family of Chebyshev methods for \(y=f(x,y)\)
A two-stage fourth-order ``almost P-stable method for oscillatory problems
Singly-implicit stabilized extended one-step methods for second-order initial-value problems with oscillating solutions
A generator of families of two-step numerical methods with free parameters and minimal phase-lag
A finite difference pair with improved phase and stability properties
Properties and implementation of \(r\)-Adams methods based on mixed-type interpolation
An accomplished phase FD process for DEs in chemistry
A phase fitted FinDiff process for DifEquns in quantum chemistry
A multistage two-step fraught in phase scheme for problems in mathematical chemistry
A Runge-Kutta type crowded in phase algorithm for quantum chemistry problems
A perfect in phase FD algorithm for problems in quantum chemistry
A multiple stage absolute in phase scheme for chemistry problems
An economical eighth-order method for the approximation of the solution of the Schrödinger equation
A P-STABLE EIGHTEENTH-ORDER SIX-STEP METHOD FOR PERIODIC INITIAL VALUE PROBLEMS
Non-dissipative extended one-step methods for oscillatory problems
Numerical operations on oscillatory functions
A parallel ODE solver adapted to oscillatory problems
New three-stages symmetric two step method with improved properties for second order initial/boundary value problems
Review of stability and stabilization for impulsive delayed systems
A four-stages multistep fraught in phase method for quantum chemistry problems
Persistence of delayed cooperative models: impulsive control method
A finite difference method with zero phase-lag and its derivatives for quantum chemistry problems
A finite difference method with phase-lag and its derivatives equal to zero for problems in chemistry
Persistent impulsive effects on stability of functional differential equations with finite or infinite delay
Output tracking control of delayed switched systems via state-dependent switching and dynamic output feedback
New multiple stages two-step complete in phase algorithm with improved characteristics for second order initial/boundary value problems
A new four-stages two-step phase fitted scheme for problems in quantum chemistry
Fixed-time control of delayed neural networks with impulsive perturbations
New FD scheme with vanished phase-lag and its derivatives up to order six for problems in chemistry
A new algorithm with eliminated phase-lag and its derivatives up to order five for problems in quantum chemistry
LMI-based stability for singularly perturbed nonlinear impulsive differential systems with delays of small parameter
EXPFIT4 -- a FORTRAN program for the numerical solution of systems of nonlinear second-order initial-value problems
Title not available (Why is that?)
A family of embedded Runge-Kutta formulae
Numerov made explicit has better stability
Exponential and Bessel fitting methods for the numerical solution of the Schrödinger equation
Dissipative Chebyshev exponential-fitted methods for numerical solution of second-order differential equations.
Trigonometrically fitted nonlinear two-step methods for solving second order oscillatory IVPs
Runge-Kutta-Nyström methods adapted to the numerical integration of perturbed oscillators
A trigonometrically fitted explicit hybrid method for the numerical integration of orbital problems
P-stable high-order super-implicit and Obrechkoff methods for periodic initial value problems
P-stable exponentially-fitted Obrechkoff methods of arbitrary order for second-order differential equations
Phase-fitted and amplification-fitted two-step hybrid methods for \(y^{\prime\prime }=f(x,y)\)
New methods for oscillatory systems based on ARKN methods
Stabilization of Cowell's method
\(P\)-stable Obrechkoff methods of arbitrary order for second-order differential equations
Symmetric Multistip Methods for Periodic Initial Value Problems
A General Procedure For the Adaptation of Multistep Algorithms to the Integration of Oscillatory Problems
P-stability and exponential-fitting methods for y = f(x,y)
An improved trigonometrically fitted P-stable Obrechkoff method for periodic initial-value problems
A PHASE-FITTED AND AMPLIFICATION-FITTED EXPLICIT TWO-STEP HYBRID METHOD FOR SECOND-ORDER PERIODIC INITIAL VALUE PROBLEMS
Mixed collocation methods for \(y=f(x,y)\)
Exponentially fitted variable two-step BDF algorithm for first order ODEs
Phase properties of high order, almost P-stable formulae
A variable step method for the numerical integration of the one- dimensional Schrödinger equation
A Noumerov-type method with minimal phase-lag for the integration of second order periodic initial-value problems. II: Explicit method
A finite-difference method for the numerical solution of the Schrödinger equation
An explicit sixth-order method with phase-lag of order eight for \(y=f(t,y)\)
Comparison of some four-step methods for the numerical solution of the Schrödinger equation
Two-step high order hybrid explicit method for the numerical solution of the Schrödinger equation
A Runge-Kutta type implicit high algebraic order two-step method with vanished phase-lag and its first, second, third and fourth derivatives for the numerical solution of coupled differential equations arising from the Schrödinger equation
An explicit Numerov-type method for second-order differential equations with oscillating solutions
The numerical solution of coupled differential equations arising from the Schrödinger equation
Chebyshevian multistep methods for ordinary differential equations
A new two stage symmetric two-step method with vanished phase-lag and its first, second, third and fourth derivatives for the numerical solution of the radial Schrödinger equation
Families of Runge-Kutta-Nystrom Formulae
A parallel boundary value technique for singularly perturbed two-point boundary value problems
Some procedures for the construction of high-order exponentially fitted Runge-Kutta-Nyström methods of explicit type
High-order P-stable multistep methods
A new two-step hybrid method for the numerical solution of the Schrödinger equation
A new family of two stage symmetric two-step methods with vanished phase-lag and its derivatives for the numerical integration of the Schrödinger equation
Two new embedded pairs of explicit Runge-Kutta methods adapted to the numerical solution of oscillatory problems
Title not available (Why is that?)
Sixth-order symmetric and symplectic exponentially fitted Runge-Kutta methods of the Gauss type
Frequency evaluation for exponentially fitted Runge-Kutta methods
Exponentially fitted symplectic integrators of RKN type for solving oscillatory problems
Symplectic conditions for exponential fitting Runge-Kutta-Nyström methods
The optimal exponentially-fitted Numerov method for solving two-point boundary value problems
Present state-of-the-art in exponential fitting. A contribution dedicated to Liviu Ixaru on his 70th birthday
Symplectic explicit methods of Runge-Kutta-Nyström type for solving perturbed oscillators
State‐dependent switching control of delayed switched systems with stable and unstable modes
Weights of the exponential fitting multistep algorithms for first-order ODEs
Trigonometrically-fitted method for a periodic initial value problem with two frequencies
On high order symmetric and symplectic trigonometrically fitted Runge-Kutta methods with an even number of stages
Hamiltonian Boundary Value Methods (Energy Conserving Discrete Line Integral Methods)
Title not available (Why is that?)
Numerical Methods for y″ =f(x, y) via Rational Approximations for the Cosine
Symmetric and symplectic exponentially fitted Runge-Kutta methods of high order
Sixth-order symmetric and symplectic exponentially fitted modified Runge-Kutta methods of Gauss type
Structure preservation of exponentially fitted Runge-Kutta methods
Families of two-step fourth order \(P\)-stable methods for second order differential equations
Stability of explicit ARKN methods for perturbed oscillators
On the stability of impulsive functional differential equations with infinite delays
High-accuracy P-stable Methods for y^″ = f(t, y)
A hybrid method with phase-lag and derivatives equal to zero for the numerical integration of the Schrödinger equation
A method for the solution of the Schrödinger equation
\(P\)-stable higher derivative methods with minimal phase-lag for solving second order differential equations
Truncation Errors in Exponential Fitting for Oscillatory Problems
A conditionally \(P\)-stable fourth-order exponential-fitting method for \(y=f(x,y)\)
On some new low storage implementations of time advancing Runge-Kutta methods
Exponential-fitted four-step methods for
Arbitrarily precise numerical solutions of the one-dimensional Schrödinger equation
Comparison of some special optimized fourth-order Runge-Kutta methods for the numerical solution of the Schrödinger equation
Trigonometrically-fitted method with the Fourier frequency spectrum for undamped Duffing equation
Exponential fitting BDF-Runge-Kutta algorithms
Exponentially-fitted Obrechkoff methods for second-order differential equations
Accuracy and linear stability of RKN methods for solving second-order stiff problems
Optimization of explicit two-step hybrid methods for solving orbital and oscillatory problems
Adapted BDF algorithms: Higher-order methods and their stability
A low computational cost eight algebraic order hybrid method with vanished phase-lag and its first, second, third and fourth derivatives for the approximate solution of the Schrödinger equation
Exponential fitted Gauss, Radau and Lobatto methods of low order
Intervals of periodicity and absolute stability of explicit Nyström methods for y=f(x,y)
On the generation of \(P\)-stable exponentially fitted Runge-Kutta-Nyström methods by exponentially fitted Runge-Kutta methods.
Two-step fourth-order \(P\)-stable methods with phase-lag of order six for \(y=f(t,y)\)
Four-step exponential-fitted methods for nonlinear physical problems
Unconditionally stable Noumerov-type methods for second order differential equations
Two-step methods for the numerical solution of the Schrödinger equation
Numerov method maximally adapted to the Schrödinger equation
A new kind of discretization scheme for solving a two-dimensional time-independent Schrödinger equation
Title not available (Why is that?)
Exponential Fitting method for the time-dependent Schrödinger equation
Explicit exponentially fitted two-step hybrid methods of high order for second-order oscillatory IVPs
A Noumerov-type method with minimal phase-lag for the integration of second order periodic initial-value problems
Four step methods for \(y=f(x,y)\)
Global exponential stabilization of impulsive neural networks with unbounded continuously distributed delays
The various order explicit multistep exponential fitting for systems of ordinary differential equations
The arbitrary order implicit multistep schemes of exponential fitting and their applications
Obrechkoff one-step method fitted with Fourier spectrum for undamped Duffing equation
The Numerov method and singular potentials
Finite difference approach for the two-dimensional Schrödinger equation with application to scission-neutron emission
Exponential-fitting methods for the numerical integration of the fourth-order differential equation \(y^{IV}+f\cdot y=g\)

Cited In (2)

Phase fitted algorithm for problems in quantum chemistry
Full in phase finite difference algorithm for differential equations in quantum chemistry

Uses Software

EXPFIT4
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