A new multistage multistep full in phase algorithm with optimized characteristics for problems in chemistry (Q2419220)

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A new multistage multistep full in phase algorithm with optimized characteristics for problems in chemistry

scientific article; zbMATH DE number 7060722

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English	A new multistage multistep full in phase algorithm with optimized characteristics for problems in chemistry	scientific article; zbMATH DE number 7060722

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instance of

scholarly article

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title

A new multistage multistep full in phase algorithm with optimized characteristics for problems in chemistry (English)

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29 May 2019

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zbMATH Keywords

phase-lag

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derivative of the phase-lag

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initial value problems

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oscillating solution

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symmetric

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hybrid

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multistep

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Schrödinger equation

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describes a project that uses

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MaRDI publication profile

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full work available at URL

https://doi.org/10.1007/s10910-019-01011-6

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cites work

The numerical solution of coupled differential equations arising from the Schrödinger equation

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A new four stages symmetric two-step method with vanished phase-lag and its first derivative for the numerical integration of the Schrödinger equation

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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

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Hybrid high algebraic order two-step method with vanished phase-lag and its first and second derivatives

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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

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Four stages symmetric two-step P-stable method with vanished phase-lag and its first, second, third and fourth derivatives

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A high-order two-step phase-fitted method for the numerical solution of the Schrödinger equation

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An efficient numerical method for the solution of the Schrödinger equation

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A new high algebraic order efficient finite difference method for the solution of the Schrödinger equation

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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

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An economical eighth-order method for the approximation of the solution of the Schrödinger equation

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An efficient and computational effective method for second order problems

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An efficient and economical high order method for the numerical approximation of the Schrödinger equation

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A four stages numerical pair with optimal phase and stability properties

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A finite difference pair with improved phase and stability properties

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A hybrid finite difference pair with maximum phase and stability properties

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New finite difference pair with optimized phase and stability properties

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A new two-step finite difference pair with optimal properties

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New five-stages finite difference pair with optimized phase properties

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A five-stages symmetric method with improved phase properties

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New five-stages two-step method with improved characteristics

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New Runge-Kutta type symmetric two-step method with optimized characteristics

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New three-stages symmetric two step method with improved properties for second order initial/boundary value problems

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New Runge-Kutta type symmetric two step finite difference pair with improved properties for second order initial and/or boundary value problems

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A new multistep method with optimized characteristics for initial and/or boundary value problems

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Trigonometrical fitting conditions for two derivative Runge-Kutta methods

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New multiple stages two-step complete in phase algorithm with improved characteristics for second order initial/boundary value problems

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New four stages multistep in phase algorithm with best possible properties for second order problems

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New multistage two-step complete in phase scheme with improved properties for quantum chemistry problems

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New hybrid two-step method with optimized phase and stability characteristics

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New hybrid symmetric two step scheme with optimized characteristics for second order problems

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A finite-difference method for the numerical solution of the Schrödinger equation

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New modified Runge-Kutta-Nyström methods for the numerical integration of the Schrödinger equation

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An exponentially-fitted and trigonometrically-fitted method for the numerical solution of periodic initial-value problems.

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A new explicit hybrid four-step method with vanished phase-lag and its derivatives

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An eight-step semi-embedded predictor-corrector method for orbital problems and related IVPs with oscillatory solutions for which the frequency is unknown

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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

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Comparison of some four-step methods for the numerical solution of the Schrödinger equation

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A family of embedded Runge-Kutta formulae

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A Noumerov-type method with minimal phase-lag for the integration of second order periodic initial-value problems. II: Explicit method

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Two-step high order hybrid explicit method for the numerical solution of the Schrödinger equation

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A variable step method for the numerical integration of the one- dimensional Schrödinger equation

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published in

Journal of Mathematical Chemistry

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Identifiers

zbMATH Open document ID

1414.81279

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Mathematics Subject Classification ID

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10.1007/S10910-019-01011-6

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Sitelinks

Mathematics(1 entry)

mardi A new multistage multistep full in phase algorithm with optimized characteristics for problems in chemistry