19 Pull requests merged by 8 people

• A hybrid potential "NEP+ILP" for graphene and h-BN

  #835 merged Dec 26, 2024

• Update Tools

  #833 merged Dec 26, 2024

• Update publications.bib

  #829 merged Dec 17, 2024

• Update publications.bib

  #828 merged Dec 16, 2024

• cp2k2xyz, selec_xyz_frames

  #826 merged Dec 13, 2024

• Update publications.bib

  #825 merged Dec 13, 2024

• Update publications.bib

  #824 merged Dec 12, 2024

• Fix HIP multi-GPU bug

  #822 merged Dec 12, 2024

• update reference

  #821 merged Dec 11, 2024

• Fix a bug of replicate command

  #820 merged Dec 10, 2024

• Update get_max_rmse_xyz.py

  #819 merged Dec 9, 2024

• Update publications.bib

  #815 merged Dec 5, 2024

• bib

  #814 merged Dec 4, 2024

• add a pull request template

  #812 merged Dec 1, 2024

• add NEP_CPU link

  #809 merged Dec 1, 2024

• Update publications.bib

  #811 merged Dec 1, 2024

• Nep and tnep

  #807 merged Nov 28, 2024

• Use binary search to find matched neighbor faster when find many body force

  #806 merged Nov 27, 2024

• Update publications.bib

  #805 merged Nov 27, 2024

5 Pull requests opened by 4 people

• add threshold_lo_ & threshold_hi_

  #816 opened Dec 7, 2024

• add threshold_lo_ & threshold_hi_

  #817 opened Dec 7, 2024

• Add functionality to support the deep potential

  #827 opened Dec 15, 2024

• output descriptor

  #832 opened Dec 24, 2024

• fix: correct nframes calculation in dp2xyz.py when multiple set.* directories exist

  #834 opened Dec 26, 2024

3 Issues opened by 3 people

• Feature request: accept additional group IDs in fix and compute shc

  #831 opened Dec 24, 2024

• Feature Request: Lorentz Force Implementation in `add_force` for Magnetic Field Simulation

  #810 opened Dec 1, 2024

• NEP for organic system

  #808 opened Nov 29, 2024

1 Unresolved conversation

Sometimes conversations happen on old items that aren’t yet closed. Here is a list of all the Issues and Pull Requests with unresolved conversations.

• which version is single-precision computing

  #794 commented on Dec 5, 2024 • 0 new comments