Solving the 1D Schrödinger equation for a particle in an anharmonic potential
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Updated
May 23, 2024 - Jupyter Notebook
Solving the 1D Schrödinger equation for a particle in an anharmonic potential
A numerical solution to the Schrodinger's equation with a web interface and customisable expermient engine and initial conditions
Artifitial Neural Networks for Solving Ordinary and Partial Differential Equations, in this case, Schrodinger's Equation for One Particle in a 1-Dimentional Box
DeepErwin is a python 3.8+ package that implements and optimizes JAX 2.x wave function models for numerical solutions to the multi-electron Schrödinger equation. DeepErwin supports weight-sharing when optimizing wave functions for multiple nuclear geometries and the usage of pre-trained neural network weights to accelerate optimization.
⚛️ A module for solving and visualizing the Schrödinger equation.
Non-linear Schrodinger Equation Solver
This package implements the Lanczos algorithm and the conjugate gradient method on an irregular grid.
Variational Quantum Simulation of General Processes
Introduction to Quantum Mechanics for Chemists
Make interactive scatterplots of atomic orbitals and animate them.
Deep Denoising by Quantum Interactive Patches. A deep neural network called DIVA unfolding a baseline adaptive denoising algorithm (De-QuIP), relying on the theory of quantum many-body physics.
Variational approximation by Gridap package to resolve T.I.S.E. in Julia
ANI-1 neural net potential with python interface (ASE)
Implements the Time-Independant Schrödinger Equation numerically to solve for the stationary wavefunctions and energy states of a quantum system.
This repository contains implementation of beginner to intermediate concepts in computational physics
Simple codes to solve the schrodinger equation
Korringa-Kohn-Rostoker (multiple scattering theory/Green's function method) band structure calculation
Augmented Plane Waves (both APW and LAPW), band structure computation
Scattering on a Lennard-Jones potential, cross-section computation.
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