Comparison of some four-step methods for the numerical solution of the Schrödinger equation
From MaRDI portal
Publication:1822909
DOI10.1016/0010-4655(85)90100-6zbMath0679.65053OpenAlexW2115796890MaRDI QIDQ1822909
Publication date: 1985
Published in: Computer Physics Communications (Search for Journal in Brave)
Full work available at URL: https://doi.org/10.1016/0010-4655(85)90100-6
Closed and approximate solutions to the Schrödinger, Dirac, Klein-Gordon and other equations of quantum mechanics (81Q05) Numerical methods for initial value problems involving ordinary differential equations (65L05)
Related Items
A new fourteenth algebraic order finite difference method for the approximate solution of the Schrödinger equation, An economical eighth-order method for the approximation of the solution of the Schrödinger equation, New five-stages finite difference pair with optimized phase properties, A new six-step algorithm with improved properties for the numerical solution of second order initial and/or boundary value problems, A new three-stages six-step finite difference pair with optimal phase properties for second order initial and/or boundary value problems with periodical and/or oscillating solutions, A five-stages symmetric method with improved phase properties, Numerical methods for the eigenvalue determination of second-order ordinary differential equations, A phase-fitting, first and second derivatives phase-fitting singularly P-stable economical two-step method for problems in chemistry, A phase-fitting, first, second and third derivatives phase-fitting singularly P-stable economical two-step method for problems in quantum chemistry, Three stages symmetric six-step method with eliminated phase-lag and its derivatives for the solution of the Schrödinger equation, Fourth derivative singularly P-stable method for the numerical solution of the Schrödinger equation, An efficient six-step method for the solution of the Schrödinger equation, An efficient and computational effective method for second order problems, A phase fitted FiniteDiffr process for DiffrntEqutns in chemistry, A complete in phase FiniteDiffrnc algorithm for DiffrntEqutins in chemistry, Full in phase finite difference algorithm for differential equations in quantum chemistry, New multiple stages two-step complete in phase algorithm with improved characteristics for second order initial/boundary value problems, New multiple stages multistep method with best possible phase properties for second order initial/boundary value problems, New four stages multistep in phase algorithm with best possible properties for second order problems, New multistage two-step complete in phase scheme with improved properties for quantum chemistry problems, A new multistage multistep full in phase algorithm with optimized characteristics for problems in chemistry, A new four-stages two-step phase fitted scheme for problems in quantum chemistry, Solution of quantum chemical problems using an extremely successful and reasonably cost two-step, fourteenth-order phase-fitting approach, Solution of quantum chemical problems by a very effective and relatively inexpensive two-step, fourteenth-order, phase-fitting procedure, Phase-fitting, singularly P-stable, cost-effective two-step approach to solving problems in quantum chemistry with vanishing phase-lag derivatives up to order 6, Two-step, fourteenth-order, phase-fitting procedure with high efficiency and minimal cost for chemical problems, Highly efficient, singularly P-stable, and low-cost phase-fitting two-step method of 14th order for problems in chemistry, A family of high-order multistep methods with vanished phase-lag and its derivatives for the numerical solution of the Schrödinger equation, An exceedingly effective and inexpensive two-step, fourteenth-order phase-fitting method for solving quantum chemical issues, Phase fitted algorithm for problems in quantum chemistry, A finite difference method with zero phase-lag and its derivatives for quantum chemistry problems, Complete in phase method for problems in chemistry, A finite difference method with phase-lag and its derivatives equal to zero for problems in chemistry, Solution to quantum chemistry problems using a phase-fitting, singularly P-stable, cost-effective two-step approach with disappearing phase-lag derivatives up to order 5, A new four-step hybrid type method with vanished phase-lag and its first derivatives for each level for the approximate integration of the Schrödinger equation, AN EMBEDDED RUNGE–KUTTA METHOD WITH PHASE-LAG OF ORDER INFINITY FOR THE NUMERICAL SOLUTION OF THE SCHRÖDINGER EQUATION, Two-step method with vanished phase-lag and its derivatives for problems in quantum chemistry: an economical case, An economical two-step method with optimal phase and stability properties for problems in chemistry, A NEW METHODOLOGY FOR THE CONSTRUCTION OF OPTIMIZED RUNGE–KUTTA–NYSTRÖM METHODS, A new explicit four-step method with vanished phase-lag and its first and second derivatives, An accomplished phase FD process for DEs in chemistry, A new four-step Runge-Kutta type method with vanished phase-lag and its first, second and third derivatives for the numerical solution of the Schrödinger equation, An integrated in phase FD procedure for DiffEqns in chemical problems, A phase fitted FinDiff process for DifEquns in quantum chemistry, A complete in phase FinitDiff procedure for DiffEquns in 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, A new high algebraic order efficient finite difference method for the 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, A predictor-corrector explicit four-step method with vanished phase-lag and its first, second and third derivatives for the numerical integration of the Schrödinger equation, New three-stages symmetric six-step finite difference method with vanished phase-lag and its derivatives up to sixth derivative for second order initial and/or boundary value problems with periodical and/or oscillating solutions, New hybrid two-step method with optimized phase and stability characteristics, New Runge-Kutta type symmetric two-step method with optimized characteristics, An implicit symmetric linear six-step methods with vanished phase-lag and its first, second, third and fourth derivatives for the numerical solution of the radial Schrödinger equation and related problems, 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, Family of symmetric linear six-step methods with vanished phase-lag and its derivatives and their application to the radial Schrödinger equation and related problems, A new finite difference method with optimal phase and stability properties for problems in chemistry, Efficient FinDiff algorithm with optimal phase properties for problems in quantum chemistry, New FD methods with phase-lag and its derivatives equal to zero for periodic initial value problems, A new method with vanished phase-lag and its derivatives of the highest order for problems in quantum chemistry, A new FinDiff numerical scheme with phase-lag and its derivatives equal to zero for periodic initial value problems, 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, A family of embedded explicit six-step methods with vanished phase-lag and its derivatives for the numerical integration of the Schrödinger equation: development and theoretical analysis, A new four stages symmetric two-step method with vanished phase-lag and its first derivative for the numerical integration of the Schrödinger equation, A family of two-stage two-step methods for the numerical integration of the Schrödinger equation and related IVPs with oscillating solution, Two optimized symmetric eight-step implicit methods for initial-value problems with oscillating solutions, A new methodology for the development of numerical methods for the numerical solution of the Schrödinger equation, A new methodology for the construction of numerical methods for the approximate solution of the Schrödinger equation, High order multistep methods with improved phase-lag characteristics for the integration of the Schrödinger equation, A multistep method with optimal phase and stability properties for problems in quantum chemistry, Numerov method maximally adapted to the Schrödinger equation, A multistep conditionally P-stable method with phase properties of high order for problems in quantum chemistry, A new two-step hybrid method for the numerical solution of the Schrödinger equation, New five-stages two-step method with improved characteristics, A new high algebraic order four stages symmetric two-step method with vanished phase-lag and its first and second derivatives for the numerical solution of the Schrödinger equation and related problems, A family of two stages tenth algebraic order symmetric six-step methods with vanished phase-lag and its first derivatives for the numerical solution of the radial Schrödinger equation and related problems, A new eight algebraic order embedded explicit six-step method with vanished phase-lag and its first, second, third and fourth derivatives for the numerical solution of the Schrödinger equation, A phase-fitting and first derivative phase-fitting singularly P-stable economical two-step method for problems in quantum chemistry, Coleman's method maximally adapted to the Schrödinger equation, A new optimized symmetric 8-step semi-embedded predictor-corrector method for the numerical solution of the radial Schrödinger equation and related orbital problems, P-stability, trigonometric-fitting and the numerical solution of the radial Schrödinger equation, High algebraic order methods with vanished phase-lag and its first derivative for the numerical solution of the Schrödinger equation, Mulitstep methods with vanished phase-lag and its first and second derivatives for the numerical integration of the Schrödinger equation, A new high order two-step method with vanished phase-lag and its derivatives for the numerical integration 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, High order four-step hybrid method with vanished phase-lag and its derivatives for the approximate solution of the Schrödinger equation, New high order multiderivative explicit four-step methods with vanished phase-lag and its derivatives for the approximate solution of the Schrödinger equation. I: construction and theoretical analysis, New optimized explicit modified RKN methods for the numerical solution of the Schrödinger equation, An efficient and economical high order method for the numerical approximation of the Schrödinger equation, A generator of families of two-step numerical methods with free parameters and minimal phase-lag, New open modified trigonometrically-fitted Newton-Cotes type multilayer symplectic integrators for the numerical solution of the Schrödinger equation, A multistep method with optimal properties for second order differential equations, A four stages numerical pair with optimal phase and stability properties, A finite difference pair with improved phase and stability properties, New two stages high order symmetric six-step method with vanished phase-lag and its first, second and third derivatives for the numerical solution of the Schrödinger equation, Numerical methods for solving radial Schrödinger equations, A hybrid finite difference pair with maximum phase and stability properties, New finite difference pair with optimized phase and stability properties, A new hybrid two-step method with vanished phase-lag and its first and second derivatives for the numerical solution of the Schrödinger equation and related problems, A hybrid method with phase-lag and derivatives equal to zero for the numerical integration of the Schrödinger equation, New four-stages symmetric six-step method with improved phase properties for second order problems with periodical and/or oscillating solutions, New Runge-Kutta type symmetric two step finite difference pair with improved properties for second order initial and/or boundary value problems, A new multistep method with optimized characteristics for initial and/or boundary value problems, New multiple stages scheme with improved properties for second order problems, Two-step high order hybrid explicit method for the numerical solution of the Schrödinger equation, An explicit four-step method with vanished phase-lag and its first and second derivatives, A Runge-Kutta type four-step method with vanished phase-lag and its first and second derivatives for each level for the numerical integration of the Schrödinger equation, A new explicit hybrid four-step method with vanished phase-lag and its derivatives, An explicit linear six-step method with vanished phase-lag and its first derivative, A family of explicit linear six-step methods with vanished phase-lag and its first derivative, A family of ten-step methods with vanished phase-lag and its first derivative for the numerical solution of the Schrödinger equation, A two-step method with vanished phase-lag and its first two derivatives for the numerical solution of the Schrödinger equation, An eighth-order formula for the numerical integration of the one- dimensional Schrödinger equation, New three-stages symmetric two step method with improved properties for second order initial/boundary value problems, New hybrid symmetric two step scheme with optimized characteristics for second order problems, A hybrid type four-step method with vanished phase-lag and its first, second and third derivatives for each level for the numerical integration of the Schrödinger equation, A high algebraic order predictor-corrector explicit method with vanished phase-lag and its first, second, third and fourth derivatives for the numerical solution of the Schrödinger equation and related problems, Efficient low computational cost hybrid explicit four-step method with vanished phase-lag and its first, second, third and fourth derivatives for the numerical integration of the Schrödinger equation, A high algebraic order multistage explicit four-step method with vanished phase-lag and its first, second, third, fourth and fifth derivatives for the numerical solution of the Schrödinger equation, 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, A new multistep finite difference pair for the Schrödinger equation and related problems, A new two-step finite difference pair with optimal properties, Modified two-derivative Runge-Kutta methods for the Schrödinger equation, An efficient numerical method for the solution of the Schrödinger equation, Four step methods for \(y=f(x,y)\), 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, Two stages six-step method with eliminated phase-lag and its first, second, third and fourth derivatives for the approximation of the Schrödinger equation, High order computationally economical six-step method with vanished phase-lag and its derivatives for the numerical solution of the Schrödinger equation, Trigonometrically fitted two-step Obrechkoff linear methods for the Schrödinger equation, A three-stages multistep teeming in phase algorithm for computational problems in chemistry, A four-stages multistep fraught in phase method for quantum chemistry problems, Exponentially and trigonometrically fitted methods for the solution of the Schrödinger equation, A family of eight-step methods with vanished phase-lag and its derivatives for the numerical integration of the Schrödinger equation, A family of four-step trigonometrically-fitted methods and its application to the Schrödinger equation, High order closed Newton-Cotes exponentially and trigonometrically fitted formulae as multilayer symplectic integrators and their application to the radial Schrödinger equation, A new economical method with eliminated phase-lag and its derivative for problems in chemistry, A new method with improved phase-lag and stability properties for problems in quantum chemistry - an economical case, An economical two-step method with improved phase and stability properties for problems in chemistry, A new improved economical finite difference method for problems in quantum chemistry, A phase-fitting singularly P-stable economical two-step method for problems in quantum chemistry, A singularly P-stable two-step method with improved characteristics for problems in chemistry, A new Numerov-type method for the numerical solution of the Schrödinger equation, A family of Runge-Kutta methods with zero phase-lag and derivatives for the numerical solution of the Schrödinger equation and related problems, High order phase fitted multistep integrators for the Schrödinger equation with improved frequency tolerance, Phase fitted method for quantum chemistry problems, Four-step exponential-fitted methods for nonlinear physical problems, A phase-fitting singularly P-stable cost-effective two-step method for solving chemistry problems, A two-step method singularly P-Stable with improved properties for problems in quantum chemistry, A two-step singularly P-Stable method with high phase and large stability properties for problems in chemistry
Cites Work
