Issues

• Segmentation fault when using Sum with IP Glue + IP GAP in QUIP v0.10.2/0.10.3

  libAtoms/QUIP#726 · Filter by author codeforcrystals opened on May 18, 2026
  2

• meson install does not install executables (no bin dir, gap_fit missing)

  libAtoms/QUIP#722 · Filter by author stenczelt opened on May 4, 2026

• gap_fit broken in new Python wheels

  libAtoms/QUIP#719 · Filter by author alanmlewis opened on Apr 16, 2026
  3

• Please write Fortran code by following the standard.

  libAtoms/QUIP#718 · Filter by author xwuupb opened on Apr 10, 2026
  2

• pip install quippy-ase does not work on ARM64 Ubuntu 24.04

  libAtoms/QUIP#706 · Filter by author ansobolev opened on Jan 21, 2026
  1

• SIGSEGV: Segmentation fault, when training a GAP model with big train dataset

  libAtoms/QUIP#696 · Filter by author MushroomYa opened on Dec 13, 2025
  1

• cannot compile quippy with `make quippy

  libAtoms/QUIP#692 · Filter by author bernstei opened on Jul 24, 2025
  7

• CI tests broken

  libAtoms/QUIP#687 · Filter by author bernstei opened on May 14, 2025

• pip install quippy-ase no longer available?

  libAtoms/QUIP#685 · Filter by author KarelCuypersUA opened on Apr 30, 2025
  4

• module 'quippy' has no attribute 'potential_module'

  libAtoms/QUIP#679 · Filter by author 9Suyoung9 opened on Feb 24, 2025
  1

• Generation of configurations question

  libAtoms/QUIP#677 · Filter by author MES-physics opened on Feb 15, 2025
  5

• GAP Training tutorial fail to make potential

  libAtoms/QUIP#676 · Filter by author ladyteam opened on Feb 8, 2025
  6

• A lot of 'possibly generating empty wrappers' warning when '$make quippy'

  libAtoms/QUIP#675 · Filter by author yliu1240 opened on Feb 1, 2025

• Segmentation fault using mpi GAP_fit

  libAtoms/QUIP#673 · Filter by author Ash-Dickson opened on Jan 8, 2025
  23

• Problem to build LAMMPS with cmake(QUIP and ScaLAPACK)

  libAtoms/QUIP#670 · Filter by author ctxu-NWPU opened on Sep 4, 2024
  3

• QUIP/LAMMPS different energies for different number of cores

  libAtoms/QUIP#669 · Filter by author robertstella111 opened on Sep 3, 2024
  30

• gap_fit config_file with carriage returns breaks writing of potential

  libAtoms/QUIP#664 · Filter by author bernstei opened on Aug 13, 2024
  18

  

• RuntimeError in running the tutorial notebook

  libAtoms/QUIP#657 · Filter by author yzhang-23 opened on Jul 18, 2024
  8

• potential parameters file

  libAtoms/QUIP#647 · Filter by author niloufareabi opened on Jun 23, 2024
  4

• "Iterative GAP fitting" example using ase Vasp calculator

  libAtoms/QUIP#646 · Filter by author rbjiawen opened on Jun 21, 2024
  3

• SYSTEM ABORT: Database was created with a later version of the code. (in LAMMPS)

  libAtoms/QUIP#642 · Filter by author MES-physics opened on May 7, 2024
  2

• Let's have the makefiles cry with very old compiler versions

  libAtoms/QUIP#637 · Filter by author stenczelt opened on Apr 10, 2024
  1

• fatal error: mach/host_info.h: No such file or directory

  libAtoms/QUIP#630 · Filter by author jiarui123zhang opened on Feb 2, 2024
  4

• Regarding Absolute Error of configurations of training set

  libAtoms/QUIP#628 · Filter by author bjn123 opened on Dec 31, 2023

• Error while reading old trained models and dimer descriptors issue

  libAtoms/QUIP#627 · Filter by author OlgaChalykh opened on Dec 16, 2023
  5