Quantum Monte Carlo Simulations using QMCTorch: Backflow-Transformed Wave-Function with Differentiable Slater Atomic Orbitals and Neural Jastrow Factors

This dataset contains the files required to reproduce the illustrations in the paper. For each figure the dataset contains:

• the input file(s) used to run the simulations
• the output file(s) of the simulations
• the analysis script(s) to post-process the output files and plot the figures