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[Feature request] apply harmonic forces for a certain group of atoms

#1077

· brucefan1983 opened

on Jun 11, 2025

How to simulate Boson Path Integral Molecular Dynamics(PIMDB)

#1065

· 1597446909 opened

on May 27, 2025

migrate <code>compute_msd all_groups</code> from using <code>atomicAdd</code>

#1055

· elindgren opened

on May 22, 2025

Feature Request: Add Virtual Indenter Functionality (Analogous to LAMMPS 'fix indent') in GPUMD's MD Module for Mechanical Loading Simulations

#943

· Eulogist opened

on Mar 9, 2025

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

#831

· msingh101 opened

on Dec 24, 2024

Feature Request: Lorentz Force Implementation in <code>add_force</code> for Magnetic Field Simulation

#810

· Lenslike opened

on Dec 1, 2024

it would be better if GPUMD could consider constant potential.

#655

· linger1234567 opened

on Jun 25, 2024

Possible BUG of enhance sampling perfomed by gpumd+plumed

#619

· XIX-YANG opened

on May 10, 2024

Cell info in netcdf output

#550

· bananenpampe opened

on Jan 25, 2024

[feature request] deposit

#529

· brucefan1983 opened

on Nov 14, 2023

Extend models to higher rank tensors

#527

· erhart1 opened

on Nov 14, 2023

Feature requested: local order parameters

#385

· ZKC19940412 opened

on Feb 28, 2023

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