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 Schrodinger equation

被引:47
作者
Alolyan, Ibraheem [1 ]
Simos, T. E. [1 ,2 ,3 ]
机构
[1] King Saud Univ, Coll Sci, Dept Math, Riyadh 11451, Saudi Arabia
[2] Univ Peloponnese, Fac Econ Management & Informat, Dept Informat & Telecommun, Sci Computat Lab, Tripolis 22100, Greece
[3] Amfithea Paleon Faliron, Athens 17564, Greece
关键词
Schrodinger equation; Multistep methods; Multistage methods; Explicit methods; Interval of periodicity; P-stability; Phase-lag; Phase-fitted; Derivatives of the phase-lag; TRIGONOMETRICALLY-FITTED FORMULAS; PREDICTOR-CORRECTOR METHOD; INITIAL-VALUE PROBLEMS; RUNGE-KUTTA METHODS; LONG-TIME INTEGRATION; NUMEROV-TYPE METHOD; SYMPLECTIC METHODS; MULTIDERIVATIVE METHODS; NYSTROM METHOD; INTERNATIONAL-CONFERENCE;
D O I
10.1007/s10910-015-0529-z
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
A new Multistage high algebraic order four-step method is obtained in this paper. It is the first time in the literature that a method of this category is developed and has vanishing of the phase-lag and its first, second, third, fourth and fifth derivatives. We study this new method by investigating: (1) the development of the new method, i.e. the calculation of the coefficients of the method in order the phase-lag and its first, second, third, fourth and fifth derivatives of the phase-lag to be vanished, (2) the determination of the formula of the Local Truncation Error, (3) the comparative analysis of the Local Truncation Error (with this we mean the application of the new method and similar methods on a test problem and the analysis of their behavior), (4) the stability of the new method, by applying the new obtained method to a scalar test equation with frequency different than the frequency of the scalar test equation for the phase-lag analysis and by studying the results of this application i.e. by investigating the interval of periodicity of the new obtained method. We finally study the computational behavior the new developed method by using the application of the new method to the approximate solution of the resonance problem of the radial Schrodinger equation. We prove the effectiveness of the new obtained method by comparing it with (1) well known methods of the literature and (2) very recently obtained methods.
引用
收藏
页码:1915 / 1942
页数:28
相关论文
共 121 条
[1]   A new family of symmetric linear four-step methods for the efficient integration of the Schrodinger equation and related oscillatory problems [J].
Alolyan, I. ;
Anastassi, Z. A. ;
Simos, T. E. .
APPLIED MATHEMATICS AND COMPUTATION, 2012, 218 (09) :5370-5382
[2]   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 Schrodinger equation [J].
Alolyan, Ibraheem ;
Simos, T. E. .
JOURNAL OF MATHEMATICAL CHEMISTRY, 2015, 53 (08) :1808-1834
[3]   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 Schrodinger equation [J].
Alolyan, Ibraheem ;
Simos, T. E. .
JOURNAL OF MATHEMATICAL CHEMISTRY, 2014, 52 (09) :2334-2379
[4]   A family of explicit linear six-step methods with vanished phase-lag and its first derivative [J].
Alolyan, Ibraheem ;
Simos, T. E. .
JOURNAL OF MATHEMATICAL CHEMISTRY, 2014, 52 (08) :2087-2118
[5]   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 Schrodinger equation [J].
Alolyan, Ibraheem ;
Simos, T. E. .
JOURNAL OF MATHEMATICAL CHEMISTRY, 2014, 52 (03) :917-947
[6]   A new four-step hybrid type method with vanished phase-lag and its first derivatives for each level for the approximate integration of the Schrodinger equation [J].
Alolyan, Ibraheem ;
Simos, T. E. .
JOURNAL OF MATHEMATICAL CHEMISTRY, 2013, 51 (09) :2542-2571
[7]   A family of high-order multistep methods with vanished phase-lag and its derivatives for the numerical solution of the Schrodinger equation [J].
Alolyan, Ibraheem ;
Simos, T. E. .
COMPUTERS & MATHEMATICS WITH APPLICATIONS, 2011, 62 (10) :3756-3774
[8]   A family of exponentially-fitted Runge-Kutta methods with exponential order up to three for the numerical solution of the Schrodinger equation [J].
Anastassi, Z. A. ;
Simos, T. E. .
JOURNAL OF MATHEMATICAL CHEMISTRY, 2007, 41 (01) :79-100
[9]   A parametric symmetric linear four-step method for the efficient integration of the Schrodinger equation and related oscillatory problems [J].
Anastassi, Z. A. ;
Simos, T. E. .
JOURNAL OF COMPUTATIONAL AND APPLIED MATHEMATICS, 2012, 236 (16) :3880-3889
[10]   Numerical multistep methods for the efficient solution of quantum mechanics and related problems [J].
Anastassi, Z. A. ;
Simos, T. E. .
PHYSICS REPORTS-REVIEW SECTION OF PHYSICS LETTERS, 2009, 482 :1-240