- Please make sure both Sympy and Matplotlib are installed, using the links in the "Documentation" section.
- Git clone this repository into the desired location.
The documentation is available here
This is experimental code for quantum mechanics, in order to be used for teaching purpose.
The PySyComp library created uses Sympy and Matplotlib libraries as a backend. This library is still in progress.
Note that the "Tutorials" folder contains foundations of quantum mechanics such as:
-
Commutators & Operators
-
Plotting Particle in a Box
- Normalization
- Expectation Values
- Plotting
- Quantized Hamiltonian Dynamics
- Morse Potential
- Gaussian Potential
- Double Well Potential
Some of the other areas of interest are:
Spherical Harmonics, Harmonic Oscillators, Anharmonic Oscillators, Perturbation Theory, Ladder Operators
Some areas of higher level research for implementing the code can be found in the following files, and are not intended for teaching purposes:
heisenberg_EOM (Heisenberg Equation of Motion - in progress)
gaussian_wavepackets (Gaussian Wave Packets - in progress)
PySyComp: A Symbolic Python Library for the Undergraduate Quantum Chemistry Course
Cite PySyComp:
Elizabeth Stippell, Alexey V. Akimov, and Oleg V. Prezhdo
Journal of Chemical Education 2023 100 (10), 4077-4084
DOI: 10.1021/acs.jchemed.2c00974
=======
This code is created by Elizabeth Stippell, Lauryn Jerz under the guidance of Dr. Alexey Akimov at the University at Buffalo
Year: 2020