Published March 31, 2026 | Version v1
Dataset Open

Data for our paper on Non-Negative Least Squares Reweighting and Pruning of Quadrature Grids for Tensor Hypercontraction.

  • 1. ROR icon Stanford University
  • 2. SLAC National Accelerator Laboratory

Description

This ZIP folder contains all the data and scripts used to make all the figures in the main text and SI the paper. It also contains input files, output files.

The folder is structured as follows:

'Figure_x' contains data and python scripts necessary to generate and plot the data.

'LibTHC' contains the python library used to run all non-TeraChem calculations.

Files

Zenodo_folder.zip

Files (96.1 MB)

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md5:0c91d9da860ef0a762e96f992d8cf808
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