Alternatives and similar repositories for lammps_interface

Users that are interested in lammps_interface are comparing it to the libraries listed below

• paduagroup / fftool
  Tool to build force field input files for molecular simulation
  ☆186Updated last month
• hernanchavezthielemann / GRO2LAM
  Gromacs to Lammps simulation converter
  ☆89Updated 2 years ago
• MaginnGroup / PyLAT
  ☆112Updated 3 years ago
• iRASPA / RASPA2
  Classical molecular simulation code
  ☆157Updated last year
• robinzyb / cp2kdata
  cp2k postprocessing tools
  ☆76Updated last month
• SINGROUP / pycp2k
  Python Cp2k interface
  ☆100Updated 3 years ago
• freitas-rodrigo / FreeEnergyLAMMPS
  Examples demonstrating how to reproduce the results in the paper.
  ☆70Updated last year
• orlandoacevedo / IL
  Ionic liquid force field parameters (OPLS-2009IL and OPLS-VSIL)
  ☆73Updated last year
• EfremBraun / calc-ir-spectra-from-lammps
  This code shows how to calculate an IR spectrum from a LAMMPS MD simulation.
  ☆53Updated 7 years ago
• materialyzeai / pymatgen-analysis-diffusion
  This add-on to pymatgen provides tools for analyzing diffusion in materials.
  ☆133Updated last month
• paduagroup / clandp
  Force field for ionic liquids
  ☆71Updated last month
• materialyzeai / mlearn
  Benchmark Suite for Machine Learning Interatomic Potentials for Materials
  ☆109Updated 3 years ago
• SarkisovGitHub / PoreBlazer
  PoreBlazer (v4.0) source code, examples, and geometric properties of porous materials calculated for the subset of 12,000 structures from…
  ☆54Updated 2 years ago
• by-student-2017 / lammps_education_reaxff_win
  ☆39Updated 3 months ago
• tobacco-mofs / tobacco_3.0
  ☆69Updated 4 years ago
• akohlmey / topotools
  VMD plugin for manipulating topology information
  ☆41Updated 8 months ago
• nanotheorygroup / kaldo
  Anharmonic Lattice Dynamics
  ☆170Updated last week
• VASPsol / VASPsol
  ☆75Updated 9 months ago
• BingqingCheng / ASAP
  ASAP is a package that can quickly analyze and visualize datasets of crystal or molecular structures.
  ☆152Updated last year
• core-cof / CoRE-COF-Database
  ☆66Updated last year
• FitSNAP / FitSNAP
  Software for generating machine-learning interatomic potentials for LAMMPS
  ☆182Updated 3 months ago
• compchem-cybertraining / Tutorials_CP2K
  Tutorials on CP2K calculations
  ☆62Updated 4 years ago
• zhenxingwang / lammps-conp
  Constant potential method in LAMMPS
  ☆52Updated 2 years ago
• dadaoqiuzhi / RMD_Digging
  RMD_digging is aimed to provide pre-processing and post-processing tools for the reactive molecular dynamics (ReaxFF) simulations based o…
  ☆49Updated 8 months ago
• lammpstutorials / lammpstutorials-inputs
  LAMMPS input from lammpstutorials.github.io
  ☆58Updated 4 months ago
• deepmodeling / reacnetgenerator
  an automatic reaction network generator for reactive molecular dynamics simulation
  ☆95Updated last week
• MarsalekGroup / aml
  A... M... L...
  ☆52Updated 3 years ago
• henniggroup / VASPsol
  Solvation model for the plane wave DFT code VASP.
  ☆171Updated 4 months ago
• lammpstutorials / lammpstutorials.github.io
  LAMMPS tutorials for both beginners and advanced users
  ☆133Updated 4 months ago
• kbsezginel / lammps-data-file
  [UNMAINTAINED] Lammps data file creation
  ☆28Updated 7 years ago