Te. Simos et Ps. Williams, BESSEL AND NEUMANN-FITTED METHODS FOR THE NUMERICAL-SOLUTION OF THE RADIAL SCHRODINGER-EQUATION, Computers & chemistry, 21(3), 1997, pp. 175-179
Two two-step methods for the numerical solution of some problems relat
ed to the Schrodinger equation are developed in this paper. One is of
the Numerov type and of algebraic order 4 and the other is of the Rung
e-Kutta type and of algebraic order 5. Each of these have free paramet
ers that are defined such that the methods are fitted to spherical Bes
sel and Neumann functions. From these methods a variable-step techniqu
e is devised. This variable-step technique is applied to the phase-shi
ft and resonance problems of the radial Schrodinger equation. Results
indicate that the new approach is more efficient than several other we
ll-known methods. (C) 1997 Elsevier Science Ltd.