From ab94dcc39a236940b29582a992e31eef3219defa Mon Sep 17 00:00:00 2001 From: orosmatthew Date: Mon, 22 Apr 2024 11:52:38 -0400 Subject: [PATCH] Comment numerov --- numerov.py | 62 ++++++++++++++++++++++++++++++++++++++++++++++++++++++ 1 file changed, 62 insertions(+) create mode 100644 numerov.py diff --git a/numerov.py b/numerov.py new file mode 100644 index 0000000..1edc43a --- /dev/null +++ b/numerov.py @@ -0,0 +1,62 @@ +""" +--- Title: Schrodinger Equation in Harmonic Potential +--- Author: Matt Evans (mtdevans.com) +--- Copyright: Do what you want with it. + +This program basically just draws the functions for a +given value of epsilon. Epsilon should be an integer n+1/2 +for good solutions. +""" + +import pylab as lab + +iterations = 60000 # iterations for approximation + +step = 0.0001 # step size for x +step_sqrd = pow(step, 2) # square of step size + +epsilon = 2.5 # energy level, should be integer n+1/2 for good solutions + +psi = 0.0 # initial value of wave function +potential = 0.0 # initial value of the potential energy function +pos = -1 * (iterations - 2) * step # initial value of the position + +potential_past_2 = epsilon + pos - 2 * step # k_0, potential energy at two steps before current +potential_past_1 = epsilon + pos - step # k_1, potential energy at one step before current +amplitude = 0.1 # initial amplitude of wave function +psi_past_2 = 0 # y_0, wave function at two steps before current +psi_past_1 = amplitude # y_1, wave function at one step before current + +x_out = [] # list to store x values for plotting +y_out = [] # list to store y values for plotting + +count = -1 * iterations + 2 # counter for the loop + +# Numerov integration loop +while count < iterations - 2: + count += 1 + pos += step + potential = 2 * epsilon - pow(pos, 2) # potential energy function + b = step_sqrd / 12 # constant used for Numerov + # Numerov method to calculate psi at current step + psi = ((2 * (1 - 5 * b * potential_past_1) * psi_past_1 - (1 + b * potential_past_2) * psi_past_2) + / (1 + b * potential)) + + # Save for plotting + x_out.append(pos) + y_out.append(psi) + + # Shift for next iteration + psi_past_2 = psi_past_1 + psi_past_1 = psi + potential_past_2 = potential_past_1 + potential_past_1 = potential + +# Plot +lab.figure(1) +lab.plot(x_out, y_out, label=f'epsilon = {epsilon}') +lab.xlabel("x") +lab.ylabel("y") +lab.title("Schrodinger Eqn in Harmonic Potential") +lab.legend(loc=1) +lab.show()