Issues

• panel

  uf3/uf3#141 · Filter by author mdmurshed7331-star opened on Aug 3, 2026

• Cannot exclude 1b-terms when using get_bspline_config

  uf3/uf3#138 · Filter by author FromColleWithLove opened on Jun 4, 2026
  2

• UF3 pair style parser truncates coefficient lines >1024 chars

  uf3/uf3#136 · Filter by author emirbilgili opened on Sep 16, 2025
  3

• Segmentation fault during LAMMPS run

  uf3/uf3#131 · Filter by author michaelmacisaac opened on May 16, 2025
  2

• SciPy version 1.14.1 or less must be used (hopefully temporarily) due to ndsplines

  uf3/uf3#129 · Filter by author sunghjung3 opened on Feb 3, 2025

• UF3-LAMMPS: currently not possible to have NULL element mapping

  uf3/uf3#124 · Filter by author Fraser-Birks opened on Jul 8, 2024
  1

• Partial 3-body terms

  uf3/uf3#119 · Filter by author tawe141 opened on Jun 28, 2024
  7

• Write hyperparameters to json file

  enhancement
  uf3/uf3#104 · Filter by author samdong2101 opened on Nov 28, 2023
  3

• UFcalculator energies and energy calculated directly from features don't match

  uf3/uf3#69 · Filter by author monk-04 opened on Sep 13, 2023
  3

  

• Small Bugs in export_tabulated_potential

  uf3/uf3#53 · Filter by author pmrv opened on Jul 17, 2023

• Update Python versions in testing workflow

  uf3/uf3#50 · Filter by author sxie22 opened on Jul 5, 2023

• default regularization parameters in the documentation

  uf3/uf3#43 · Filter by author paprakash opened on Feb 6, 2023
  1

• sample_weights has nonlinear effect on the fit

  uf3/uf3#41 · Filter by author sxie22 opened on Jan 13, 2023

• UFCalculator error when model has resolution 0 for an interaction

  uf3/uf3#26 · Filter by author henk789 opened on Sep 8, 2022

• Feature request: option for filtering configurations with large energies/forces

  enhancement
  uf3/uf3#6 · Filter by author sxie22 opened on Nov 29, 2021

• Command line interface and scripts

  enhancementhelp wanted
  uf3/uf3#4 · Filter by author sxie22 opened on Oct 19, 2021

• Two-and-three body support for UFCalculator and UFLammps

  enhancement
  uf3/uf3#2 · Filter by author sxie22 opened on Oct 6, 2021
  2