Alternatives and similar repositories for ALM

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

• FedeDat / VASP-tutorial
  Introductory course on the Vienna Ab Initio Simulation Package (VASP) given by Dr. Federico Dattila at the Institute of Chemical Research…
  ☆20Updated 2 years ago
• lyg-ucl / md2d
  MD2D: a python module for accurate determination of diffusion coefficient from molecular dynamics
  ☆21Updated 2 years ago
• maise-guide / maise
  MAISE Module for Ab Initio Structure Evolution (MAISE)
  ☆34Updated 10 months ago
• DefAP / defap
  DefAP is a program developed to facilitate the exploration of a material's defect chemistry. A large number of features are provided and …
  ☆20Updated last month
• xtalopt / randSpg
  Random symmetric initialization of crystals
  ☆21Updated 7 years ago
• i-pi / tutorials-schools
  ☆16Updated 3 years ago
• flokno / tools.tdep
  ☆19Updated 5 months ago
• InWonYeu / interphon
  Interfacial Phonon code
  ☆26Updated 2 years ago
• tyst3273 / pynamic-structure-factor
  python code to calculate inelastic-neutron-scattering dynamic structure factor, S(Q,w), from molecular dynamics trajectories using parall…
  ☆18Updated 2 weeks ago
• perturbo-code / perturbopy
  Suite of Python scripts for Perturbo testing and postprocessing
  ☆11Updated 2 weeks ago
• skelton-group / Phono3py-Power-Tools
  Tools for Phono(3)py power users.
  ☆33Updated last year
• utf / pymlff
  A lightweight python package for reading and writing VASP ML_AB files
  ☆36Updated 3 months ago
• rjacobs914 / VASP-Tools
  A set of tools used for setup, analysis and post-processing of Density Functional Theory (DFT) calculations performed with the VASP packa…
  ☆16Updated 7 years ago
• symfc / symfc
  Generate symmetrized force constants
  ☆21Updated last week
• vossjo / libbeef
  Library for Bayesian error estimation functionals for use in density functional theory codes
  ☆24Updated 2 years ago
• QuantumMaterialsModelling / vasp-phonopy-sscha
  ☆11Updated 2 years ago
• aradi / SCPC-Method
  ☆25Updated 5 months ago
• JMSkelton / ModeMap
  A set of tools for mapping and analysing the potential-energy surfaces along phonon modes.
  ☆42Updated last year
• sekocha / lammps-polymlp-package
  A user package of LAMMPS software enabling simulations using linearized machine learning potentials
  ☆8Updated 2 months ago
• dgehringer / sqsgenerator
  A command line tool written in Python/C++ for finding optimized SQS structures
  ☆46Updated this week
• JaGeo / IR
  Python Package to Calculate IR Intensities from the Dipole Approximation with Phonopy and VASP
  ☆29Updated 3 years ago
• SMTG-Bham / easyunfold
  Band structure unfolding made easy!
  ☆53Updated this week
• sissaschool / sportran
  A code to estimate transport coefficients from the cepstral analysis of a (multi)variate current stationary time series -- [FKA "thermoce…
  ☆42Updated 5 months ago
• zishengz / gocia
  Global Optimizer for Clusters, Interfaces, and Adsorbates
  ☆28Updated 2 months ago
• jochym / Elastic
  A module for ASE for elastic constants calculation.
  ☆42Updated 4 months ago
• kmu / cif2cell
  cif2cell compatible with Python 3+
  ☆11Updated 2 years ago
• Linux-cpp-lisp / sitator
  Unsupervised landmark analysis for jump detection in molecular dynamics simulations.
  ☆13Updated 4 years ago
• dev-zero / cp2k-tools
  DEPRECATED: Simple python scripts to somehow mangle CP2K output and generate some input
  ☆25Updated 6 years ago
• rashidrafeek / Quantum-ESPRESSO-scripts
  Python scripts to postprocess Quantum Espresso calclations.
  ☆18Updated 5 years ago
• lucydot / vesta_vectors
  A Python 3 script to visualise atomic displacement using the Vesta file format
  ☆17Updated 5 years ago