☆23Jun 2, 2024Updated 2 years ago
Alternatives and similar repositories for ALM
Users that are interested in ALM are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Generate symmetrized force constants☆28Jun 3, 2026Updated last week
- Generator of polynomial machine learning potentials☆21Jun 5, 2026Updated last week
- Crsytal simulation tools☆10Updated this week
- Heat-conductivity benchmark test for foundational machine-learning potentials☆30Jan 29, 2026Updated 4 months ago
- ☆13Apr 12, 2023Updated 3 years ago
- Deploy to Railway using AI coding agents - Free Credits Offer • AdUse Claude Code, Codex, OpenCode, and more. Autonomous software development now has the infrastructure to match with Railway.
- Ab initio simulator for thermal transport and lattice anharmonicity☆195May 29, 2026Updated 2 weeks ago
- pymatgen-analysis-alloys is an add-on package for pymatgen intended to contain useful classes for describing alloy systems and analyzing …☆16Apr 24, 2026Updated last month
- Calculates the pair distribution function (PDF) of a POSCAR file.☆12Mar 7, 2016Updated 10 years ago
- A demo code for implementation of differentiable thermodynamic modeling in JAX.☆11Sep 18, 2021Updated 4 years ago
- Calculates Projected Phonon Spectral Energy Density (SED) from molecular dynamics atomic velocity data and phonon eigenvectors☆21Jul 18, 2020Updated 5 years ago
- Phonons from ML force fields☆25Mar 22, 2026Updated 2 months ago
- More efficient and faster version of pyscal☆31May 1, 2026Updated last month
- Anharmonic Lattice Dynamics☆186May 29, 2026Updated 2 weeks ago
- Minimum-strain symmetrization of Bravais lattices☆18May 14, 2020Updated 6 years ago
- Deploy to Railway using AI coding agents - Free Credits Offer • AdUse Claude Code, Codex, OpenCode, and more. Autonomous software development now has the infrastructure to match with Railway.
- A high-performance software package for training and evaluating machine-learned XC functionals using the CIDER framework☆20Apr 9, 2026Updated 2 months ago
- Geometric analysis of crystal structures☆16Jun 16, 2022Updated 3 years ago
- Random symmetric initialization of crystals☆25Jan 6, 2018Updated 8 years ago
- MAISE Module for Ab Initio Structure Evolution (MAISE)☆36May 20, 2026Updated 3 weeks ago
- The FPTE package is a collection of tools for finite pressure temperature elastic constants calculation. Features include, but are not l…☆17Jan 19, 2025Updated last year
- A tool for generating unique ordered structures corresponding to a given disordered structure.☆18Dec 28, 2023Updated 2 years ago
- A Python Package to Automate Thermodynamic Integration Calculations for Free Energy☆36Updated this week
- Python scripts to investigate the phonon transport for perfect crystal on the basis of NEGF theory☆24Jun 23, 2020Updated 5 years ago
- Python interface for VASP☆97May 21, 2026Updated 3 weeks ago
- Deploy to Railway using AI coding agents - Free Credits Offer • AdUse Claude Code, Codex, OpenCode, and more. Autonomous software development now has the infrastructure to match with Railway.
- ☆21Dec 19, 2024Updated last year
- Utility for applying the distortion symmetry method.☆28Feb 21, 2024Updated 2 years ago
- Description, readme and source-files for crystIT, a python based program to calculated complexity measures for crystal structures based o…☆16Dec 24, 2025Updated 5 months ago
- A plugin to AiiDA for running simulations with VASP☆65Updated this week
- ☆23Mar 18, 2024Updated 2 years ago
- High-throughput materials discovery.☆22Apr 27, 2026Updated last month
- Atomistica is a library of interatomic potentials that is compatible with ASE and LAMMPS☆93May 11, 2026Updated last month
- MOFSimBench: Evaluating universal machine learning interatomic potentials in metal-organic framework molecular modeling☆42Dec 17, 2025Updated 5 months ago
- A user package of LAMMPS software enabling simulations using linearized machine learning potentials☆11Feb 4, 2026Updated 4 months ago
- Deploy to Railway using AI coding agents - Free Credits Offer • AdUse Claude Code, Codex, OpenCode, and more. Autonomous software development now has the infrastructure to match with Railway.
- python workflow toolkit☆43Dec 23, 2025Updated 5 months ago
- A general parser for VASP☆15Jun 2, 2026Updated last week
- Vizualisation of Atomic Contributions to Phonon Modes☆13Nov 6, 2024Updated last year
- Suite of Python scripts for Perturbo testing and postprocessing☆17Oct 2, 2025Updated 8 months ago
- Python codes to calculate phonon spectral energy density from LAMMPS velocity data.☆30Jan 21, 2021Updated 5 years ago
- The python implementation of the Stochastic Self-Consistent Harmonic Approximation (SSCHA).☆80May 21, 2026Updated 3 weeks ago
- ☆20Jan 22, 2022Updated 4 years ago