A collection of structures, force constants and phonon data obtained from first-principles calculations
☆41Sep 13, 2020Updated 5 years ago
Alternatives and similar repositories for Phonons
Users that are interested in Phonons are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Tools for Phono(3)py power users.☆36Oct 23, 2023Updated 2 years ago
- Julia codes to play with Phonons☆24Nov 7, 2018Updated 7 years ago
- A tool for plotting phonon dispersion curves and phonon density of states.☆11Oct 1, 2020Updated 5 years ago
- A code to simulate linearized phonon transport☆15May 7, 2017Updated 8 years ago
- Python library for computing electron-phonon renormalizations from finite displacements☆11Jan 6, 2025Updated last year
- Managed Kubernetes at scale on DigitalOcean • AdDigitalOcean Kubernetes includes the control plane, bandwidth allowance, container registry, automatic updates, and more for free.
- extract third order force constants from TDEP output☆10Jun 22, 2020Updated 5 years ago
- Crsytal simulation tools☆10Updated this week
- Python Package to Calculate IR Intensities from the Dipole Approximation with Phonopy and VASP☆29Aug 6, 2021Updated 4 years ago
- The thermal conductivity of a molecular dynamics system is calculated using the Green-Kubo fluctuation Dissipation Theorem☆15Feb 11, 2021Updated 5 years ago
- A wrapper for many computational codes of thermal conductivity☆27Jul 6, 2022Updated 3 years ago
- A general forcefield for phonon properties of metal-organic frameworks☆13Sep 13, 2020Updated 5 years ago
- Extension of almaBTE's Monte Carlo code beyond the relaxation-time approximation.☆10Sep 24, 2023Updated 2 years ago
- Dealing with slabs for first principles calculations of surfaces☆66Sep 17, 2023Updated 2 years ago
- A set of tools for mapping and analysing the potential-energy surfaces along phonon modes.☆48May 6, 2024Updated last year
- Managed Kubernetes at scale on DigitalOcean • AdDigitalOcean Kubernetes includes the control plane, bandwidth allowance, container registry, automatic updates, and more for free.
- Band unfolding for phonons☆62Oct 23, 2024Updated last year
- A simulation package of phonon-phonon interaction related properties☆161Apr 8, 2026Updated last week
- Thermodynamics of solids in the quasiharmonic approximation.☆39Apr 1, 2026Updated 2 weeks ago
- DFT optimised crystal structures of inorganic and hybrid halide perovskites☆111Sep 3, 2019Updated 6 years ago
- Blender extensions for illustrations of phonons☆69Mar 6, 2019Updated 7 years ago
- Visualise lattice vibrations☆107Apr 4, 2026Updated last week
- A tool for streamlining data analysis and visualisation for thermoelectrics and charge carrier transport in computational materials scien…☆53May 9, 2025Updated 11 months ago
- ⚗️ matador is an aggregator, manipulator and runner of first-principles calculations, written with a bent towards battery 🔋 electrode ma…☆35Feb 1, 2026Updated 2 months ago
- python code to calculate inelastic-neutron-scattering dynamic structure factor, S(Q,w), from molecular dynamics trajectories using parall…☆22Aug 19, 2025Updated 7 months ago
- Bare Metal GPUs on DigitalOcean Gradient AI • AdPurpose-built for serious AI teams training foundational models, running large-scale inference, and pushing the boundaries of what's possible.
- An extension module to ShengBTE for computing four-phonon scattering rates and thermal conductivity☆79Mar 26, 2026Updated 2 weeks ago
- Making life easier using scripting languages (Bash and Python) to facilitate multiple VASP simulation jobs preparation, submission and an…☆13Dec 15, 2014Updated 11 years ago
- Ab initio simulator for thermal transport and lattice anharmonicity☆188Mar 4, 2026Updated last month
- Phonon anharmonicity analysis from molecular dynamics☆137Apr 7, 2026Updated last week
- A collection of tools for simulating vibrational spectra, which interfaces with the Phonopy package.☆184Mar 23, 2026Updated 3 weeks ago
- Point symmetry analysis tool for theoretical chemistry objects☆22Apr 7, 2026Updated last week
- Construct phonon tight-binding model and calculate its topological properties☆27Sep 15, 2019Updated 6 years ago
- Electronic transport properties from first-principles calculations☆158Mar 16, 2026Updated 3 weeks ago
- This API_Phonons is a set of python scripts and functions for interfacing different packages for phonon modeling.☆35Jan 6, 2026Updated 3 months ago
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting for WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Deploy in minutes on Cloudways by DigitalOcean.
- The project represents a Python framework for computing the electron transport characteristics using the non-equilibrium Green's function…☆12May 13, 2019Updated 6 years ago
- A software to calculate thermal conductivity quickly and accurately☆38Feb 20, 2020Updated 6 years ago
- Docs and examples for Quantum-Espresso☆17May 25, 2017Updated 8 years ago
- A crystallographic visualizer for Python, compatible with files from common softwares like Quantum ESPRESSO, VASP, CP2K, etc.☆22Oct 15, 2024Updated last year
- Interfacial Phonon code☆28Jul 31, 2022Updated 3 years ago
- Quick tools for materials chemistry☆19May 29, 2024Updated last year
- Materials informatics framework for ab initio data repositories☆18Aug 16, 2022Updated 3 years ago