Family of phase fitted 3-step second-order BDF methods for solving periodic and orbital quantum chemistry problems
DOI10.1007/S10910-024-01619-3zbMATH Open1543.65109MaRDI QIDQ6579158FDOQ6579158
Authors: H. Saadat, Sanaz Hami Hassan Kiyadeh, Ramin Goudarzi Karim, Ali Safaie 
Publication date: 25 July 2024
Published in: Journal of Mathematical Chemistry (Search for Journal in Brave)
Recommendations
- An explicit four-step phase-fitted method for the numerical integration of second-order initial-value problems
- An exceedingly effective and inexpensive two-step, fourteenth-order phase-fitting method for solving quantum chemical issues
- A generalized family of symmetric multistep methods with minimal phase-lag for initial value problems in ordinary differential equations
- Some new variable-step methods with minimal phase lag for the numerical integration of special second-order initial-value problem
- Symmetric multistep Obrechkoff methods with zero phase-lag for periodic initial value problems of second order differential equations
initial value problemsphase-lagSchrödinger equationperiodic and orbital problemsphase fitted methodssecond-order BDFs
Nonlinear ordinary differential equations and systems (34A34) Numerical solution of boundary value problems involving ordinary differential equations (65L10) Numerical methods for initial value problems involving ordinary differential equations (65L05) Biology, chemistry, medicine (aspects of mathematics education) (97M60)
Cites Work
- Stabilization of Cowell's method
- P-Stable Obrechkoff Methods with Minimal Phase-Lag for Periodic Initial Value Problems
- Symmetric Multistip Methods for Periodic Initial Value Problems
- Phase properties of high order, almost P-stable formulae
- A finite-difference method for the numerical solution of the Schrödinger equation
- Chebyshevian multistep methods for ordinary differential equations
- A parametric symmetric linear four-step method for the efficient integration of the Schrödinger equation and related oscillatory problems
- A family of implicit Chebyshev methods for the numerical integration of second-order differential equations
- Numerical Methods for y″ =f(x, y) via Rational Approximations for the Cosine
- Phase fitted method for quantum chemistry problems
- A new two stages tenth algebraic order symmetric six-step method with vanished phase-lag and its first and second derivatives for the solution of the radial Schrödinger equation and related problems
- Numerical methods for solving radial Schrödinger equations
- A Noumerov-type method with minimal phase-lag for the integration of second order periodic initial-value problems
- High order P-stable formulae for the numerical integration of periodic initial value problems
- Damping and phase analysis for some methods for solving second-order ordinary differential equations
- New FD scheme with vanished phase-lag and its derivatives up to order six for problems in chemistry
- Symmetric linear multistep methods for second-order differential equations with periodic solutions
- THDRK methods with vanished phase-lag and its first derivative for the Schrödinger equation
- New four stages multistep in phase algorithm with best possible properties for second order problems
This page was built for publication: Family of phase fitted 3-step second-order BDF methods for solving periodic and orbital quantum chemistry problems
Report a bug (only for logged in users!)Click here to report a bug for this page (MaRDI item Q6579158)
