Tim Bechtel's repositories
perov_solar_ml
Test feasability of predicting perovskite solar cell properties using machine learning.
jraph_MPEU
Message Passing Graph Neural Network with Edge Updates in Jraph
CP2_QPP
Simulate the time evolution of the quantum point particle in an external potential
flax
Flax is a neural network library for JAX that is designed for flexibility.
MCising
Design and write a code to generate a Markov chain which simulates the Ising model, using theMetropolis algorithm (explained in the lecture notes). You should consider a lattice withDdimensions,Npoints in each direction and periodic boundary conditions. You may recycle the geometry codedeveloped for the time-dependent Schrödinger equation.
optax
Optax is a gradient processing and optimization library for JAX.
painn-jax
PaiNN in jax
ptable_trends
Python script to plot periodic trends as a heat map over the periodic table of elements