Overview
Introductory lecture material
Programming
Basic numerical methods
Methods and Algorithms
Molecular Dynamics
Hartree-Fock method
Density functional theory
Monte Carlo methods
Quantum Monte Carlo methods
Lanczos method
Perturbation theory
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Lecture notes in pdf format:
Part1
Part2
Part3
Source code for this part of lectures
.emacs
small plot script
Code plots Mandelbrot set using fortran, C++, Perl and Python
Prints some numeric limits
Computes Bessel functions with upward and downward recursion, shows the error.
Glues fortran and C++ to Python using f2py and weaver
Calling a Fortran routine in C++. Simple example to compute modified erfc function
Calling a minimization Fortran routine in C++. Using static class function to avoid use of global variables.
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