A reference implementation for a quantum virtual machine in Python

Time-evolution of a wavefunction using a Krylov subspace expansion

A wave function tunneling across a barrier

Visualization with animation and interactive plot

Set of quantum chemistry programs and libraries

Artificial neural networks applied as molecular wave function solvers

This repository contains necessary lines of code that are required in solving the time-independent Schrodinger equation. It also contains graphs that are made visually appealing, in .pdf format. These plots are acquired from running the lines of codes that are also attached to this repository.

Program for calculating the energies of the eigenstates of hydrogen, as well as writing the specified (radial) wavefunction to a .txt file. This is my solution to a homework problem in computational atomic physics.

A Rust module for manipulating VASP WAVECAR.

Continuous symmetry measures (CSM) of electronic wave function

2D 3D Time independent FDM Schrodinger equation solver for arbitrary shape of well

A proof-of-concept implementation of Wave Function Collapse (WFC) in Blockland.

Schrödinger-like simulator of quantum computers

A dive into the quantum world for a software engineer with no prior knowledge of quantum physics

An efficient toolkit for chemical resonance analysis based on quantum chemistry calculations. It implements the quantitative theory of resonance by expansion of the wave function from a DFT/HF calculation in terms of those of the Lewis structures.

A quantum wave function evolution simulator.

Visualizing waves on a string in Python with adjustable initial conditions (defluctance, wave speed, damping, etc. adjustable in the code)

pythonic way

Modeling and Crystallographic Utilities

Practical session for the Quantum Dynamics course of the "Atomistic and Multiscale Computational Modelling" Master Degree. Course 2022-2023.